4-(8-azanyl-3-oxidanylidene-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid

Systemtic Name: 4-(8-azanyl-3-oxidanylidene-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid Openeye Name: 4-(8-amino-3-oxo-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid CAS Name: 4-(8-amino-3-oxo-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid IUPAC Name: 4-(8-amino-3-oxo-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid Traditional Name: 4-(8-amino-3-keto-5,6-dihydrobenzo[h]cinnolin-2-yl)butyric acid Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)N)C3=NN(C(=O)C=C31)CCCC(=O)O

Isomeric SMILES

C1CC2=C(C=CC(=C2)N)C3=NN(C(=O)C=C31)CCCC(=O)O

InChI

InChI=1S/C16H17N3O3/c17-12-5-6-13-10(8-12)3-4-11-9-14(20)19(18-16(11)13)7-1-2-15(21)22/h5-6,8-9H,1-4,7,17H2,(H,21,22)