4-[(4-azanyl-2-methoxy-phenyl)amino]-N-methylsulfonyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(4-azanyl-2-methoxy-phenyl)amino]-N-methylsulfonyl-3-nitro-benzenesulfonamide Openeye Name: 4-(4-amino-2-methoxy-anilino)-N-methylsulfonyl-3-nitro-benzenesulfonamide CAS Name: 4-(4-amino-2-methoxyanilino)-N-methylsulfonyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(4-amino-2-methoxyanilino)-N-methylsulfonyl-3-nitrobenzenesulfonamide Traditional Name: 4-(4-amino-2-methoxy-anilino)-N-mesyl-3-nitro-benzenesulfonamide Formula: C14H16N4O7S2 MolecularWeight: 416.42944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N)NC2=C(C=C(C=C2)S(=O)(=O)NS(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)N)NC2=C(C=C(C=C2)S(=O)(=O)NS(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O7S2/c1-25-14-7-9(15)3-5-12(14)16-11-6-4-10(8-13(11)18(19)20)27(23,24)17-26(2,21)22/h3-8,16-17H,15H2,1-2H3