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

Systemtic Name: ethyl 4-[[(E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[(E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)prop-2-enoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)acryloyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H27ClN2O5 MolecularWeight: 410.89178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=CC(=O)NC2CCN(CC2)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)/C=C/C(=O)NC2CCN(CC2)C(=O)OCC)OC

InChI

InChI=1S/C20H27ClN2O5/c1-4-27-19-16(21)12-14(13-17(19)26-3)6-7-18(24)22-15-8-10-23(11-9-15)20(25)28-5-2/h6-7,12-13,15H,4-5,8-11H2,1-3H3,(H,22,24)/b7-6+