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

Systemtic Name: dodecyl 2-[1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 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 dodecyl ester IUPAC Name: dodecyl 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 lauryl ester Formula: C29H44N2O5 MolecularWeight: 500.67006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C=CC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)/C=C/C2=CC=C(C=C2)OCC

InChI

InChI=1S/C29H44N2O5/c1-3-5-6-7-8-9-10-11-12-13-22-36-28(33)23-26-29(34)30-20-21-31(26)27(32)19-16-24-14-17-25(18-15-24)35-4-2/h14-19,26H,3-13,20-23H2,1-2H3,(H,30,34)/b19-16+