N-cyclopropyl-4-methoxy-3-[(2-methoxy-5-nitro-phenyl)methylamino]benzenesulfonamide

Systemtic Name: N-cyclopropyl-4-methoxy-3-[(2-methoxy-5-nitro-phenyl)methylamino]benzenesulfonamide Openeye Name: N-cyclopropyl-4-methoxy-3-[(2-methoxy-5-nitro-phenyl)methylamino]benzenesulfonamide CAS Name: N-cyclopropyl-4-methoxy-3-[(2-methoxy-5-nitrophenyl)methylamino]benzenesulfonamide IUPAC Name: N-cyclopropyl-4-methoxy-3-[(2-methoxy-5-nitrophenyl)methylamino]benzenesulfonamide Traditional Name: N-cyclopropyl-4-methoxy-3-[(2-methoxy-5-nitro-benzyl)amino]benzenesulfonamide Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])CNC2=C(C=CC(=C2)S(=O)(=O)NC3CC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])CNC2=C(C=CC(=C2)S(=O)(=O)NC3CC3)OC

InChI

InChI=1S/C18H21N3O6S/c1-26-17-7-5-14(21(22)23)9-12(17)11-19-16-10-15(6-8-18(16)27-2)28(24,25)20-13-3-4-13/h5-10,13,19-20H,3-4,11H2,1-2H3