[4-(3-methylphenyl)piperazin-1-yl]-[(2S)-pyrrolidin-1-ium-2-yl]methanone

Systemtic Name: [4-(3-methylphenyl)piperazin-1-yl]-[(2S)-pyrrolidin-1-ium-2-yl]methanone Openeye Name: [4-(m-tolyl)piperazin-1-yl]-[(2S)-pyrrolidin-1-ium-2-yl]methanone CAS Name: [4-(3-methylphenyl)-1-piperazinyl]-[(2S)-2-pyrrolidin-1-iumyl]methanone IUPAC Name: [4-(3-methylphenyl)piperazin-1-yl]-[(2S)-pyrrolidin-1-ium-2-yl]methanone Traditional Name: [4-(m-tolyl)piperazino]-[(2S)-pyrrolidin-1-ium-2-yl]methanone Formula: C16H24N3O+ MolecularWeight: 274.38126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3CCC[NH2+]3

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O/c1-13-4-2-5-14(12-13)18-8-10-19(11-9-18)16(20)15-6-3-7-17-15/h2,4-5,12,15,17H,3,6-11H2,1H3/p+1/t15-/m0/s1