N,N-diethyl-4-[(4-methoxy-3-oxidanyl-phenyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[(4-methoxy-3-oxidanyl-phenyl)amino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-(3-hydroxy-4-methoxy-anilino)-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-(3-hydroxy-4-methoxyanilino)-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-(3-hydroxy-4-methoxyanilino)-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-(3-hydroxy-4-methoxy-anilino)-3-nitro-benzenesulfonamide Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O6S/c1-4-19(5-2)27(24,25)13-7-8-14(15(11-13)20(22)23)18-12-6-9-17(26-3)16(21)10-12/h6-11,18,21H,4-5H2,1-3H3