4-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxidanylidene-1,8-naphthyridin-3-yl]butanoic acid

Systemtic Name: 4-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxidanylidene-1,8-naphthyridin-3-yl]butanoic acid Openeye Name: 4-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxo-1,8-naphthyridin-3-yl]butanoic acid CAS Name: 4-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxo-1,8-naphthyridin-3-yl]butanoic acid IUPAC Name: 4-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxo-1,8-naphthyridin-3-yl]butanoic acid Traditional Name: 4-[4-(3-chlorophenyl)-1-ethyl-2-keto-7-methyl-1,8-naphthyridin-3-yl]butyric acid Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=N2)C)C(=C(C1=O)CCCC(=O)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN1C2=C(C=CC(=N2)C)C(=C(C1=O)CCCC(=O)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O3/c1-3-24-20-16(11-10-13(2)23-20)19(14-6-4-7-15(22)12-14)17(21(24)27)8-5-9-18(25)26/h4,6-7,10-12H,3,5,8-9H2,1-2H3,(H,25,26)