[4-(3-methylphenyl)piperazin-1-yl]-[(2R)-piperidin-1-ium-2-yl]methanone

Systemtic Name: [4-(3-methylphenyl)piperazin-1-yl]-[(2R)-piperidin-1-ium-2-yl]methanone Openeye Name: [4-(m-tolyl)piperazin-1-yl]-[(2R)-piperidin-1-ium-2-yl]methanone CAS Name: [4-(3-methylphenyl)-1-piperazinyl]-[(2R)-2-piperidin-1-iumyl]methanone IUPAC Name: [4-(3-methylphenyl)piperazin-1-yl]-[(2R)-piperidin-1-ium-2-yl]methanone Traditional Name: [4-(m-tolyl)piperazino]-[(2R)-piperidin-1-ium-2-yl]methanone Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3CCCC[NH2+]3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)[C@H]3CCCC[NH2+]3

InChI

InChI=1S/C17H25N3O/c1-14-5-4-6-15(13-14)19-9-11-20(12-10-19)17(21)16-7-2-3-8-18-16/h4-6,13,16,18H,2-3,7-12H2,1H3/p+1/t16-/m1/s1