methyl 4-phenyl-1-[1-(2-phenylethanoyl)piperidin-3-yl]carbonyl-piperidine-4-carboxylate

Systemtic Name: methyl 4-phenyl-1-[1-(2-phenylethanoyl)piperidin-3-yl]carbonyl-piperidine-4-carboxylate Openeye Name: methyl 4-phenyl-1-[1-(2-phenylacetyl)piperidine-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[1-(1-oxo-2-phenylethyl)-3-piperidinyl]methyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-phenyl-1-[1-(2-phenylacetyl)piperidine-3-carbonyl]piperidine-4-carboxylate Traditional Name: 4-phenyl-1-[1-(2-phenylacetyl)nipecotoyl]isonipecotic acid methyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)C(=O)C2CCCN(C2)C(=O)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1(CCN(CC1)C(=O)C2CCCN(C2)C(=O)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H32N2O4/c1-33-26(32)27(23-12-6-3-7-13-23)14-17-28(18-15-27)25(31)22-11-8-16-29(20-22)24(30)19-21-9-4-2-5-10-21/h2-7,9-10,12-13,22H,8,11,14-20H2,1H3