methyl 1-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]piperidine-4-carboxylate CAS Name: 1-[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]piperidine-4-carboxylate Traditional Name: 1-[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]isonipecotic acid methyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)N2CCC(CC2)C(=O)OC)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)N2CCC(CC2)C(=O)OC)O

InChI

InChI=1S/C17H21NO5/c1-22-15-11-12(3-5-14(15)19)4-6-16(20)18-9-7-13(8-10-18)17(21)23-2/h3-6,11,13,19H,7-10H2,1-2H3/b6-4+