Chemical ID: 7708442

c1ccc2cc(c(cc2c1)C(=O)NN=Cc3cc4ccccc4[nH]c3=O)O
Chemical ID:
7708442
Name [?]:
None
SMILES [?]:
c1ccc2cc(c(cc2c1)C(=O)NN=Cc3cc4ccccc4[nH]c3=O)O
InChi [?]:
InChI=1/C21H15N3O3/c25-19-11-14-6-2-1-5-13(14)10-17(19)21(27)24-22-12-16-9-15-7-3-4-8-18(15)23-20(16)26/h1-12,25H,(H,23,26)(H,24,27)
InChi Info:
AuxInfo=1/1/N:1,2,20,21,10,3,19,22,17,8,5,15,9,4,18,16,7,23,6,25,11,14,24,13,27,26,12/rA:27nCCCCCCCCCCCONNCCCCCCCCCNCOO/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s7;d11;s11;s13;w14;s15;d16;s17;s18;d19;s20;d21;d18s22;s23;s16s24;d25;s6;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H15N3O3
All Atoms:42
Heavy Atoms:27
Chiral Atoms:None
ZAP Information [?]
Total:7.4112
Area:565.998
Solvation:-6.73874
Coulombic:-55.0714
Bond Count [?]
All:30
Single:18
Double:12
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.42
LogP (Chemaxon):None

Name Annotations

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Descriptor Annotations

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