[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(6-methoxynaphthalen-2-yl)methyl]-methyl-azanium

Systemtic Name: [2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(6-methoxynaphthalen-2-yl)methyl]-methyl-azanium Openeye Name: [2-(5-chloro-2-nitro-anilino)-2-oxo-ethyl]-[(6-methoxy-2-naphthyl)methyl]-methyl-ammonium CAS Name: [2-(5-chloro-2-nitroanilino)-2-oxoethyl]-[(6-methoxy-2-naphthalenyl)methyl]-methylammonium IUPAC Name: [2-(5-chloro-2-nitroanilino)-2-oxoethyl]-[(6-methoxynaphthalen-2-yl)methyl]-methylazanium Traditional Name: [2-(5-chloro-2-nitro-anilino)-2-keto-ethyl]-[(6-methoxy-2-naphthyl)methyl]-methyl-ammonium Formula: C21H21ClN3O4+ MolecularWeight: 414.86214

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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=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O4/c1-24(12-14-3-4-16-10-18(29-2)7-5-15(16)9-14)13-21(26)23-19-11-17(22)6-8-20(19)25(27)28/h3-11H,12-13H2,1-2H3,(H,23,26)/p+1