dimethyl-[2-[[4-(naphthalen-1-ylamino)-3-nitro-phenyl]sulfonylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[4-(naphthalen-1-ylamino)-3-nitro-phenyl]sulfonylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[4-(1-naphthylamino)-3-nitro-phenyl]sulfonylamino]ethyl]ammonium CAS Name: dimethyl-[2-[[4-(1-naphthalenylamino)-3-nitrophenyl]sulfonylamino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[4-(naphthalen-1-ylamino)-3-nitrophenyl]sulfonylamino]ethyl]azanium Traditional Name: dimethyl-[2-[[4-(1-naphthylamino)-3-nitro-phenyl]sulfonylamino]ethyl]ammonium Formula: C20H23N4O4S+ MolecularWeight: 415.48602

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCNS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4S/c1-23(2)13-12-21-29(27,28)16-10-11-19(20(14-16)24(25)26)22-18-9-5-7-15-6-3-4-8-17(15)18/h3-11,14,21-22H,12-13H2,1-2H3/p+1