[5-chloranyl-2-[(4-nitrophenyl)carbamoyl]phenyl]-dimethyl-sulfo-azanium

Systemtic Name: [5-chloranyl-2-[(4-nitrophenyl)carbamoyl]phenyl]-dimethyl-sulfo-azanium Openeye Name: [5-chloro-2-[(4-nitrophenyl)carbamoyl]phenyl]-dimethyl-sulfo-ammonium CAS Name: [5-chloro-2-[(4-nitroanilino)-oxomethyl]phenyl]-dimethyl-sulfoammonium IUPAC Name: [5-chloro-2-[(4-nitrophenyl)carbamoyl]phenyl]-dimethyl-sulfoazanium Traditional Name: [5-chloro-2-[(4-nitrophenyl)carbamoyl]phenyl]-dimethyl-sulfo-ammonium Formula: C15H15ClN3O6S+ MolecularWeight: 400.8141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=C(C=CC(=C1)Cl)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C[N+](C)(C1=C(C=CC(=C1)Cl)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C15H14ClN3O6S/c1-19(2,26(23,24)25)14-9-10(16)3-8-13(14)15(20)17-11-4-6-12(7-5-11)18(21)22/h3-9H,1-2H3,(H-,17,20,23,24,25)/p+1