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

Systemtic Name: ethyl 4-[(E)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[(E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-1-oxoprop-2-enyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)prop-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[(E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)acryloyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H25ClN2O5 MolecularWeight: 396.8652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)N2CCN(CC2)C(=O)OCC)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)N2CCN(CC2)C(=O)OCC)Cl)OC

InChI

InChI=1S/C19H25ClN2O5/c1-4-26-16-13-14(12-15(20)18(16)25-3)6-7-17(23)21-8-10-22(11-9-21)19(24)27-5-2/h6-7,12-13H,4-5,8-11H2,1-3H3/b7-6+