dodecyl 2-[1-[2-(2-methylphenyl)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[1-[2-(2-methylphenyl)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-[2-(o-tolyl)acetyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2-methylphenyl)-1-oxoethyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-[2-(2-methylphenyl)acetyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(o-tolyl)acetyl]piperazin-2-yl]acetic acid lauryl ester Formula: C27H42N2O4 MolecularWeight: 458.63338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)CC2=CC=CC=C2C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)CC2=CC=CC=C2C

InChI

InChI=1S/C27H42N2O4/c1-3-4-5-6-7-8-9-10-11-14-19-33-26(31)21-24-27(32)28-17-18-29(24)25(30)20-23-16-13-12-15-22(23)2/h12-13,15-16,24H,3-11,14,17-21H2,1-2H3,(H,28,32)