methyl 1-[(E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]piperidine-4-carboxylate CAS Name: 1-[(E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)prop-2-enoyl]piperidine-4-carboxylate Traditional Name: 1-[(E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)acryloyl]isonipecotic acid methyl ester Formula: C19H24ClNO5 MolecularWeight: 381.85056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=CC(=O)N2CCC(CC2)C(=O)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)/C=C/C(=O)N2CCC(CC2)C(=O)OC)OC

InChI

InChI=1S/C19H24ClNO5/c1-4-26-18-15(20)11-13(12-16(18)24-2)5-6-17(22)21-9-7-14(8-10-21)19(23)25-3/h5-6,11-12,14H,4,7-10H2,1-3H3/b6-5+