methyl 1-[1-[1-(phenylmethyl)piperidin-4-yl]piperidin-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[1-[1-(phenylmethyl)piperidin-4-yl]piperidin-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[1-(1-benzyl-4-piperidyl)piperidine-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[1-[1-(phenylmethyl)-4-piperidinyl]-3-piperidinyl]methyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-(1-benzylpiperidin-4-yl)piperidine-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(1-benzyl-4-piperidyl)nipecotoyl]isonipecotic acid methyl ester Formula: C25H37N3O3 MolecularWeight: 427.57958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2CCCN(C2)C3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2CCCN(C2)C3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H37N3O3/c1-31-25(30)21-9-16-27(17-10-21)24(29)22-8-5-13-28(19-22)23-11-14-26(15-12-23)18-20-6-3-2-4-7-20/h2-4,6-7,21-23H,5,8-19H2,1H3