[4-[(2-methylphenyl)methyl]piperazin-1-yl]-(1-methylsulfonylpiperidin-3-yl)methanone hydrochloride

Systemtic Name: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(1-methylsulfonylpiperidin-3-yl)methanone hydrochloride Openeye Name: (1-methylsulfonyl-3-piperidyl)-[4-(o-tolylmethyl)piperazin-1-yl]methanone hydrochloride CAS Name: [4-[(2-methylphenyl)methyl]-1-piperazinyl]-(1-methylsulfonyl-3-piperidinyl)methanone hydrochloride IUPAC Name: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(1-methylsulfonylpiperidin-3-yl)methanone hydrochloride Traditional Name: (1-mesyl-3-piperidyl)-[4-(2-methylbenzyl)piperazino]methanone hydrochloride Formula: C19H30ClN3O3S MolecularWeight: 415.9778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C.Cl

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C.Cl

InChI

InChI=1S/C19H29N3O3S.ClH/c1-16-6-3-4-7-17(16)14-20-10-12-21(13-11-20)19(23)18-8-5-9-22(15-18)26(2,24)25;/h3-4,6-7,18H,5,8-15H2,1-2H3;1H