[(1R)-1-(3-chlorophenyl)ethyl]-[(2S)-1-[methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(1R)-1-(3-chlorophenyl)ethyl]-[(2S)-1-[methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1R)-1-(3-chlorophenyl)ethyl]-[(1S)-1-methyl-2-[methyl-[2-(4-methylanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]ammonium CAS Name: [(1R)-1-(3-chlorophenyl)ethyl]-[(2S)-1-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(1R)-1-(3-chlorophenyl)ethyl]-[(2S)-1-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-1-oxopropan-2-yl]azanium Traditional Name: [(1R)-1-(3-chlorophenyl)ethyl]-[(1S)-2-keto-2-[[2-keto-2-(p-toluidino)ethyl]-methyl-amino]-1-methyl-ethyl]ammonium Formula: C21H27ClN3O2+ MolecularWeight: 388.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C(C)[NH2+]C(C)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)[C@H](C)[NH2+][C@H](C)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C21H26ClN3O2/c1-14-8-10-19(11-9-14)24-20(26)13-25(4)21(27)16(3)23-15(2)17-6-5-7-18(22)12-17/h5-12,15-16,23H,13H2,1-4H3,(H,24,26)/p+1/t15-,16+/m1/s1