2-methylpropyl 2-[1-[3,5-bis(chloranyl)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 2-methylpropyl 2-[1-[3,5-bis(chloranyl)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isobutyl 2-[1-(3,5-dichlorobenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(3,5-dichlorophenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[1-(3,5-dichlorobenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(3,5-dichlorobenzoyl)-3-keto-piperazin-2-yl]acetic acid isobutyl ester Formula: C17H20Cl2N2O4 MolecularWeight: 387.2577

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CC(C)COC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C17H20Cl2N2O4/c1-10(2)9-25-15(22)8-14-16(23)20-3-4-21(14)17(24)11-5-12(18)7-13(19)6-11/h5-7,10,14H,3-4,8-9H2,1-2H3,(H,20,23)