4-(3-chlorophenyl)-1,3-diethyl-3-(7-methyl-1,8-naphthyridin-3-yl)-2-oxidanylidene-piperidine-4-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-1,3-diethyl-3-(7-methyl-1,8-naphthyridin-3-yl)-2-oxidanylidene-piperidine-4-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-1,3-diethyl-3-(7-methyl-1,8-naphthyridin-3-yl)-2-oxo-piperidine-4-carboxylic acid CAS Name: 4-(3-chlorophenyl)-1,3-diethyl-3-(7-methyl-1,8-naphthyridin-3-yl)-2-oxo-4-piperidinecarboxylic acid IUPAC Name: 4-(3-chlorophenyl)-1,3-diethyl-3-(7-methyl-1,8-naphthyridin-3-yl)-2-oxopiperidine-4-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-1,3-diethyl-2-keto-3-(7-methyl-1,8-naphthyridin-3-yl)isonipecotic acid Formula: C25H26ClN3O3 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N(CCC1(C2=CC(=CC=C2)Cl)C(=O)O)CC)C3=CN=C4C(=C3)C=CC(=N4)C

Isomeric SMILES

CCC1(C(=O)N(CCC1(C2=CC(=CC=C2)Cl)C(=O)O)CC)C3=CN=C4C(=C3)C=CC(=N4)C

InChI

InChI=1S/C25H26ClN3O3/c1-4-24(19-13-17-10-9-16(3)28-21(17)27-15-19)22(30)29(5-2)12-11-25(24,23(31)32)18-7-6-8-20(26)14-18/h6-10,13-15H,4-5,11-12H2,1-3H3,(H,31,32)