[(2R)-1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]-[(1R)-1-phenylbutyl]azanium

Systemtic Name: [(2R)-1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]-[(1R)-1-phenylbutyl]azanium Openeye Name: [(1R)-1-methyl-2-(2-methylanilino)-2-oxo-ethyl]-[(1R)-1-phenylbutyl]ammonium CAS Name: [(2R)-1-(2-methylanilino)-1-oxopropan-2-yl]-[(1R)-1-phenylbutyl]ammonium IUPAC Name: [(2R)-1-(2-methylanilino)-1-oxopropan-2-yl]-[(1R)-1-phenylbutyl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(o-toluidino)ethyl]-[(1R)-1-phenylbutyl]ammonium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)[NH2+]C(C)C(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)[NH2+][C@H](C)C(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C20H26N2O/c1-4-10-19(17-12-6-5-7-13-17)21-16(3)20(23)22-18-14-9-8-11-15(18)2/h5-9,11-14,16,19,21H,4,10H2,1-3H3,(H,22,23)/p+1/t16-,19-/m1/s1