3-phenylpropyl 2-[1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 3-phenylpropyl 2-[1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: 3-phenylpropyl 2-[1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(E)-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]-3-oxo-2-piperazinyl]acetic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 2-[1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[(E)-3-p-phenetylacryloyl]piperazin-2-yl]acetic acid 3-phenylpropyl ester Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)N2CCNC(=O)C2CC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)N2CCNC(=O)C2CC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C26H30N2O5/c1-2-32-22-13-10-21(11-14-22)12-15-24(29)28-17-16-27-26(31)23(28)19-25(30)33-18-6-9-20-7-4-3-5-8-20/h3-5,7-8,10-15,23H,2,6,9,16-19H2,1H3,(H,27,31)/b15-12+