(6-methoxynaphthalen-2-yl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (6-methoxynaphthalen-2-yl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (6-methoxy-2-naphthyl)methyl-methyl-[2-(4-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: (6-methoxy-2-naphthalenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (6-methoxynaphthalen-2-yl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(4-nitroanilino)ethyl]-[(6-methoxy-2-naphthyl)methyl]-methyl-ammonium Formula: C21H22N3O4+ MolecularWeight: 380.41708

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)C=C(C=C2)OC)CC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)C=C(C=C2)OC)CC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c1-23(14-21(25)22-18-6-8-19(9-7-18)24(26)27)13-15-3-4-17-12-20(28-2)10-5-16(17)11-15/h3-12H,13-14H2,1-2H3,(H,22,25)/p+1