4-chloranyl-2-methyl-1-[2-methyl-4-(phenylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-chloranyl-2-methyl-1-[2-methyl-4-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-benzyl-2-methyl-piperazin-1-yl)-4-chloro-2-methyl-butan-1-one CAS Name: 4-chloro-2-methyl-1-[2-methyl-4-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-benzyl-2-methylpiperazin-1-yl)-4-chloro-2-methylbutan-1-one Traditional Name: 1-(4-benzyl-2-methyl-piperazino)-4-chloro-2-methyl-butan-1-one Formula: C17H25ClN2O MolecularWeight: 308.8462

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(C)CCCl)CC2=CC=CC=C2

Isomeric SMILES

CC1CN(CCN1C(=O)C(C)CCCl)CC2=CC=CC=C2

InChI

InChI=1S/C17H25ClN2O/c1-14(8-9-18)17(21)20-11-10-19(12-15(20)2)13-16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3