dimethyl-[(1S)-2-[[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethanoyl]amino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethanoyl]amino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[[2-(4-methyl-2-nitro-anilino)-2-oxo-acetyl]amino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[2-(4-methyl-2-nitroanilino)-1,2-dioxoethyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[[2-(4-methyl-2-nitroanilino)-2-oxoacetyl]amino]-1-phenylethyl]azanium Traditional Name: [(1S)-2-[[2-keto-2-(4-methyl-2-nitro-anilino)acetyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C19H23N4O4+ MolecularWeight: 371.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(=O)NCC(C2=CC=CC=C2)[NH+](C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(=O)NC[C@H](C2=CC=CC=C2)[NH+](C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-13-9-10-15(16(11-13)23(26)27)21-19(25)18(24)20-12-17(22(2)3)14-7-5-4-6-8-14/h4-11,17H,12H2,1-3H3,(H,20,24)(H,21,25)/p+1/t17-/m1/s1