2-[3-(3,4-dichlorophenyl)-2-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]ethanoic acid

Systemtic Name: 2-[3-(3,4-dichlorophenyl)-2-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]ethanoic acid Openeye Name: 2-[1-benzyl-3-(3,4-dichlorophenyl)-2-oxo-3-piperidyl]acetic acid CAS Name: 2-[3-(3,4-dichlorophenyl)-2-oxo-1-(phenylmethyl)-3-piperidinyl]acetic acid IUPAC Name: 2-[1-benzyl-3-(3,4-dichlorophenyl)-2-oxopiperidin-3-yl]acetic acid Traditional Name: 2-[1-benzyl-3-(3,4-dichlorophenyl)-2-keto-3-piperidyl]acetic acid Formula: C20H19Cl2NO3 MolecularWeight: 392.27576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)CC2=CC=CC=C2)(CC(=O)O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CC(C(=O)N(C1)CC2=CC=CC=C2)(CC(=O)O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H19Cl2NO3/c21-16-8-7-15(11-17(16)22)20(12-18(24)25)9-4-10-23(19(20)26)13-14-5-2-1-3-6-14/h1-3,5-8,11H,4,9-10,12-13H2,(H,24,25)