(4-ethoxy-3-methoxy-phenyl)methyl-methyl-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[2-(2-methyl-6-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-[2-keto-2-(2-methyl-6-nitro-anilino)ethyl]-methyl-ammonium Formula: C20H26N3O5+ MolecularWeight: 388.43754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](C)CC(=O)NC2=C(C=CC=C2[N+](=O)[O-])C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](C)CC(=O)NC2=C(C=CC=C2[N+](=O)[O-])C)OC

InChI

InChI=1S/C20H25N3O5/c1-5-28-17-10-9-15(11-18(17)27-4)12-22(3)13-19(24)21-20-14(2)7-6-8-16(20)23(25)26/h6-11H,5,12-13H2,1-4H3,(H,21,24)/p+1