N-(4-methoxyphenyl)-3-nitro-4-(2-phenoxyethylamino)benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-3-nitro-4-(2-phenoxyethylamino)benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-3-nitro-4-(2-phenoxyethylamino)benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-3-nitro-4-(2-phenoxyethylamino)benzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-3-nitro-4-(2-phenoxyethylamino)benzenesulfonamide Traditional Name: N-(4-methoxyphenyl)-3-nitro-4-(2-phenoxyethylamino)benzenesulfonamide Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NCCOC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NCCOC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O6S/c1-29-17-9-7-16(8-10-17)23-31(27,28)19-11-12-20(21(15-19)24(25)26)22-13-14-30-18-5-3-2-4-6-18/h2-12,15,22-23H,13-14H2,1H3