4-[(4-chloranyl-5,7-diethyl-2-oxidanylidene-1,6-naphthyridin-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(4-chloranyl-5,7-diethyl-2-oxidanylidene-1,6-naphthyridin-1-yl)methyl]benzoic acid Openeye Name: 4-[(4-chloro-5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]benzoic acid CAS Name: 4-[(4-chloro-5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]benzoic acid IUPAC Name: 4-[(4-chloro-5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]benzoic acid Traditional Name: 4-[(4-chloro-5,7-diethyl-2-keto-1,6-naphthyridin-1-yl)methyl]benzoic acid Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C(=C1)N(C(=O)C=C2Cl)CC3=CC=C(C=C3)C(=O)O)CC

Isomeric SMILES

CCC1=NC(=C2C(=C1)N(C(=O)C=C2Cl)CC3=CC=C(C=C3)C(=O)O)CC

InChI

InChI=1S/C20H19ClN2O3/c1-3-14-9-17-19(16(4-2)22-14)15(21)10-18(24)23(17)11-12-5-7-13(8-6-12)20(25)26/h5-10H,3-4,11H2,1-2H3,(H,25,26)