dimethyl-[(1S)-2-[[1-(2-methylphenyl)carbonylpiperidin-4-yl]carbonylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[[1-(2-methylphenyl)carbonylpiperidin-4-yl]carbonylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[[1-(2-methylbenzoyl)piperidine-4-carbonyl]amino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[[1-[(2-methylphenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[[1-(2-methylbenzoyl)piperidine-4-carbonyl]amino]-1-phenylethyl]azanium Traditional Name: dimethyl-[(1S)-2-[(1-o-toluoylisonipecotoyl)amino]-1-phenyl-ethyl]ammonium Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NCC(C3=CC=CC=C3)[NH+](C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC[C@H](C3=CC=CC=C3)[NH+](C)C

InChI

InChI=1S/C24H31N3O2/c1-18-9-7-8-12-21(18)24(29)27-15-13-20(14-16-27)23(28)25-17-22(26(2)3)19-10-5-4-6-11-19/h4-12,20,22H,13-17H2,1-3H3,(H,25,28)/p+1/t22-/m1/s1