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

Systemtic Name: methyl 1-[(E)-3-(3-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[(E)-3-(4-isopropoxy-3-methoxy-phenyl)prop-2-enoyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[(E)-3-(3-methoxy-4-propan-2-yloxyphenyl)-1-oxoprop-2-enyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enoyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[(E)-3-(4-isopropoxy-3-methoxy-phenyl)acryloyl]-4-phenyl-isonipecotic acid methyl ester Formula: C26H31NO5 MolecularWeight: 437.52804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C=CC(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)OC)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)/C=C/C(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)OC)OC

InChI

InChI=1S/C26H31NO5/c1-19(2)32-22-12-10-20(18-23(22)30-3)11-13-24(28)27-16-14-26(15-17-27,25(29)31-4)21-8-6-5-7-9-21/h5-13,18-19H,14-17H2,1-4H3/b13-11+