dimethyl-[2-[[4-(naphthalen-2-ylcarbamoyl)-2-nitro-phenyl]amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[4-(naphthalen-2-ylcarbamoyl)-2-nitro-phenyl]amino]ethyl]azanium Openeye Name: dimethyl-[2-[4-(2-naphthylcarbamoyl)-2-nitro-anilino]ethyl]ammonium CAS Name: dimethyl-[2-[4-[(2-naphthalenylamino)-oxomethyl]-2-nitroanilino]ethyl]ammonium IUPAC Name: dimethyl-[2-[4-(naphthalen-2-ylcarbamoyl)-2-nitroanilino]ethyl]azanium Traditional Name: dimethyl-[2-[4-(2-naphthylcarbamoyl)-2-nitro-anilino]ethyl]ammonium Formula: C21H23N4O3+ MolecularWeight: 379.43232

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=C(C=C(C=C1)C(=O)NC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCNC1=C(C=C(C=C1)C(=O)NC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O3/c1-24(2)12-11-22-19-10-8-17(14-20(19)25(27)28)21(26)23-18-9-7-15-5-3-4-6-16(15)13-18/h3-10,13-14,22H,11-12H2,1-2H3,(H,23,26)/p+1