ethyl 1-[3-[3,3-bis(2-methylphenyl)prop-2-enoxy]propyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[3,3-bis(2-methylphenyl)prop-2-enoxy]propyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[3,3-bis(o-tolyl)allyloxy]propyl]piperidine-3-carboxylate CAS Name: 1-[3-[3,3-bis(2-methylphenyl)prop-2-enoxy]propyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[3,3-bis(2-methylphenyl)prop-2-enoxy]propyl]piperidine-3-carboxylate Traditional Name: 1-[3-[3,3-bis(o-tolyl)allyloxy]propyl]nipecotic acid ethyl ester Formula: C28H37NO3 MolecularWeight: 435.59828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CCCOCC=C(C2=CC=CC=C2C)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CCCOCC=C(C2=CC=CC=C2C)C3=CC=CC=C3C

InChI

InChI=1S/C28H37NO3/c1-4-32-28(30)24-13-9-17-29(21-24)18-10-19-31-20-16-27(25-14-7-5-11-22(25)2)26-15-8-6-12-23(26)3/h5-8,11-12,14-16,24H,4,9-10,13,17-21H2,1-3H3