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

Systemtic Name: pentyl 2-[1-[2-(2-methylphenyl)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 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 amyl ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O4/c1-3-4-7-12-26-19(24)14-17-20(25)21-10-11-22(17)18(23)13-16-9-6-5-8-15(16)2/h5-6,8-9,17H,3-4,7,10-14H2,1-2H3,(H,21,25)