[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]azanium

Systemtic Name: [2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]azanium Openeye Name: [2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl]-[(1S)-2-methyl-1-phenyl-propyl]ammonium CAS Name: [2-(2-methyl-5-nitroanilino)-2-oxoethyl]-[(1S)-2-methyl-1-phenylpropyl]ammonium IUPAC Name: [2-(2-methyl-5-nitroanilino)-2-oxoethyl]-[(1S)-2-methyl-1-phenylpropyl]azanium Traditional Name: [2-keto-2-(2-methyl-5-nitro-anilino)ethyl]-[(1S)-2-methyl-1-phenyl-propyl]ammonium Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C[NH2+]C(C2=CC=CC=C2)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O3/c1-13(2)19(15-7-5-4-6-8-15)20-12-18(23)21-17-11-16(22(24)25)10-9-14(17)3/h4-11,13,19-20H,12H2,1-3H3,(H,21,23)/p+1/t19-/m0/s1