2-chloranyl-N-[(2S)-3-methyl-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-3-methyl-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[(1S)-2-methyl-1-[4-(o-tolylmethyl)piperazin-4-ium-1-carbonyl]propyl]benzamide CAS Name: 2-chloro-N-[(2S)-3-methyl-1-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[(2S)-3-methyl-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[(1S)-2-methyl-1-[4-(2-methylbenzyl)piperazin-4-ium-1-carbonyl]propyl]benzamide Formula: C24H31ClN3O2+ MolecularWeight: 428.97484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)[C@H](C(C)C)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C24H30ClN3O2/c1-17(2)22(26-23(29)20-10-6-7-11-21(20)25)24(30)28-14-12-27(13-15-28)16-19-9-5-4-8-18(19)3/h4-11,17,22H,12-16H2,1-3H3,(H,26,29)/p+1/t22-/m0/s1