ethyl 4-[4-[(E)-3-(4-chlorophenyl)prop-2-enoyl]piperazin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-[(E)-3-(4-chlorophenyl)prop-2-enoyl]piperazin-1-yl]benzoate Openeye Name: ethyl 4-[4-[(E)-3-(4-chlorophenyl)prop-2-enoyl]piperazin-1-yl]benzoate CAS Name: 4-[4-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-1-piperazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(E)-3-(4-chlorophenyl)prop-2-enoyl]piperazin-1-yl]benzoate Traditional Name: 4-[4-[(E)-3-(4-chlorophenyl)acryloyl]piperazino]benzoic acid ethyl ester Formula: C22H23ClN2O3 MolecularWeight: 398.88262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H23ClN2O3/c1-2-28-22(27)18-6-10-20(11-7-18)24-13-15-25(16-14-24)21(26)12-5-17-3-8-19(23)9-4-17/h3-12H,2,13-16H2,1H3/b12-5+