(5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (5-chloro-2-methoxy-phenyl)methyl-methyl-[2-(2-methyl-4-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-(2-methyl-4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-(2-methyl-4-nitroanilino)-2-oxoethyl]azanium Traditional Name: (5-chloro-2-methoxy-benzyl)-[2-keto-2-(2-methyl-4-nitro-anilino)ethyl]-methyl-ammonium Formula: C18H21ClN3O4+ MolecularWeight: 378.83004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O4/c1-12-8-15(22(24)25)5-6-16(12)20-18(23)11-21(2)10-13-9-14(19)4-7-17(13)26-3/h4-9H,10-11H2,1-3H3,(H,20,23)/p+1