(5S)-1-cyclopropyl-5-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-piperidin-2-one

Systemtic Name: (5S)-1-cyclopropyl-5-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-piperidin-2-one Openeye Name: (5S)-1-cyclopropyl-5-[4-(o-tolylmethyl)piperazin-4-ium-1-carbonyl]piperidin-2-one CAS Name: (5S)-1-cyclopropyl-5-[[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-2-piperidinone IUPAC Name: (5S)-1-cyclopropyl-5-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-carbonyl]piperidin-2-one Traditional Name: (5S)-1-cyclopropyl-5-[4-(2-methylbenzyl)piperazin-4-ium-1-carbonyl]-2-piperidone Formula: C21H30N3O2+ MolecularWeight: 356.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3CCC(=O)N(C3)C4CC4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)[C@H]3CCC(=O)N(C3)C4CC4

InChI

InChI=1S/C21H29N3O2/c1-16-4-2-3-5-17(16)14-22-10-12-23(13-11-22)21(26)18-6-9-20(25)24(15-18)19-7-8-19/h2-5,18-19H,6-15H2,1H3/p+1/t18-/m0/s1