ethyl (E)-4-[1-[2-[(4-methylphenyl)-phenyl-methoxy]ethyl]piperidin-4-yl]but-2-enoate

Systemtic Name: ethyl (E)-4-[1-[2-[(4-methylphenyl)-phenyl-methoxy]ethyl]piperidin-4-yl]but-2-enoate Openeye Name: ethyl (E)-4-[1-[2-[phenyl(p-tolyl)methoxy]ethyl]-4-piperidyl]but-2-enoate CAS Name: (E)-4-[1-[2-[(4-methylphenyl)-phenylmethoxy]ethyl]-4-piperidinyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[1-[2-[(4-methylphenyl)-phenylmethoxy]ethyl]piperidin-4-yl]but-2-enoate Traditional Name: (E)-4-[1-[2-[phenyl(p-tolyl)methoxy]ethyl]-4-piperidyl]but-2-enoic acid ethyl ester Formula: C27H35NO3 MolecularWeight: 421.5717

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCC1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)/C=C/CC1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C27H35NO3/c1-3-30-26(29)11-7-8-23-16-18-28(19-17-23)20-21-31-27(24-9-5-4-6-10-24)25-14-12-22(2)13-15-25/h4-7,9-15,23,27H,3,8,16-21H2,1-2H3/b11-7+