4-(10-methoxy-3-oxidanylidene-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid

Systemtic Name: 4-(10-methoxy-3-oxidanylidene-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid Openeye Name: 4-(10-methoxy-3-oxo-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid CAS Name: 4-(10-methoxy-3-oxo-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid IUPAC Name: 4-(10-methoxy-3-oxo-5,6-dihydrobenzo[h]cinnolin-2-yl)butanoic acid Traditional Name: 4-(3-keto-10-methoxy-5,6-dihydrobenzo[h]cinnolin-2-yl)butyric acid Formula: C17H18N2O4 MolecularWeight: 314.33582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C3=NN(C(=O)C=C3CC2)CCCC(=O)O

Isomeric SMILES

COC1=CC=CC2=C1C3=NN(C(=O)C=C3CC2)CCCC(=O)O

InChI

InChI=1S/C17H18N2O4/c1-23-13-5-2-4-11-7-8-12-10-14(20)19(9-3-6-15(21)22)18-17(12)16(11)13/h2,4-5,10H,3,6-9H2,1H3,(H,21,22)