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

Systemtic Name: pentyl 2-[1-(2-methylphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: pentyl 2-[1-(2-methylbenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(2-methylphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid pentyl ester IUPAC Name: pentyl 2-[1-(2-methylbenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-(3-keto-1-o-toluoyl-piperazin-2-yl)acetic acid amyl ester Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2C

InChI

InChI=1S/C19H26N2O4/c1-3-4-7-12-25-17(22)13-16-18(23)20-10-11-21(16)19(24)15-9-6-5-8-14(15)2/h5-6,8-9,16H,3-4,7,10-13H2,1-2H3,(H,20,23)