ethyl 1-[(E)-3-(4-methylphenyl)-3-oxidanylidene-prop-1-enyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(E)-3-(4-methylphenyl)-3-oxidanylidene-prop-1-enyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(E)-3-oxo-3-(p-tolyl)prop-1-enyl]piperidine-4-carboxylate CAS Name: 1-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]piperidine-4-carboxylate Traditional Name: 1-[(E)-3-keto-3-(p-tolyl)prop-1-enyl]isonipecotic acid ethyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C=CC(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)/C=C/C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H23NO3/c1-3-22-18(21)16-8-11-19(12-9-16)13-10-17(20)15-6-4-14(2)5-7-15/h4-7,10,13,16H,3,8-9,11-12H2,1-2H3/b13-10+