1,3-benzodioxol-5-yl (3R)-1-(4-chlorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl (3R)-1-(4-chlorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: 1,3-benzodioxol-5-yl (3R)-1-(4-chlorobenzoyl)piperidine-3-carboxylate CAS Name: (3R)-1-[(4-chlorophenyl)-oxomethyl]-3-piperidinecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (3R)-1-(4-chlorobenzoyl)piperidine-3-carboxylate Traditional Name: (3R)-1-(4-chlorobenzoyl)nipecotic acid 1,3-benzodioxol-5-yl ester Formula: C20H18ClNO5 MolecularWeight: 387.81362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18ClNO5/c21-15-5-3-13(4-6-15)19(23)22-9-1-2-14(11-22)20(24)27-16-7-8-17-18(10-16)26-12-25-17/h3-8,10,14H,1-2,9,11-12H2/t14-/m1/s1