methyl-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: methyl-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: (4-isopropylphenyl)methyl-methyl-[2-(2-methyl-6-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: (4-isopropylbenzyl)-[2-keto-2-(2-methyl-6-nitro-anilino)ethyl]-methyl-ammonium Formula: C20H26N3O3+ MolecularWeight: 356.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C20H25N3O3/c1-14(2)17-10-8-16(9-11-17)12-22(4)13-19(24)21-20-15(3)6-5-7-18(20)23(25)26/h5-11,14H,12-13H2,1-4H3,(H,21,24)/p+1