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

Systemtic Name: pentyl 2-[1-(3-chlorophenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: pentyl 2-[1-(3-chlorobenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(3-chlorophenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid pentyl ester IUPAC Name: pentyl 2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(3-chlorobenzoyl)-3-keto-piperazin-2-yl]acetic acid amyl ester Formula: C18H23ClN2O4 MolecularWeight: 366.83922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23ClN2O4/c1-2-3-4-10-25-16(22)12-15-17(23)20-8-9-21(15)18(24)13-6-5-7-14(19)11-13/h5-7,11,15H,2-4,8-10,12H2,1H3,(H,20,23)