3-chloranyl-1-[4-(3,4-dimethylphenyl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-chloranyl-1-[4-(3,4-dimethylphenyl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 3-chloro-1-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]propan-1-one CAS Name: 3-chloro-1-[4-[(3,4-dimethylphenyl)-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-chloro-1-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]propan-1-one Traditional Name: 3-chloro-1-[4-(3,4-dimethylbenzoyl)piperazino]propan-1-one Formula: C16H21ClN2O2 MolecularWeight: 308.80314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCCl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCCl)C

InChI

InChI=1S/C16H21ClN2O2/c1-12-3-4-14(11-13(12)2)16(21)19-9-7-18(8-10-19)15(20)5-6-17/h3-4,11H,5-10H2,1-2H3