N-(3-bromophenyl)-2-[(4-methoxyphenyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(3-bromophenyl)-2-[(4-methoxyphenyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]ethanamide Openeye Name: N-(3-bromophenyl)-2-(4-methoxy-N-(4-methyl-3-nitro-phenyl)sulfonyl-anilino)acetamide CAS Name: N-(3-bromophenyl)-2-(4-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)acetamide IUPAC Name: N-(3-bromophenyl)-2-(4-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)acetamide Traditional Name: N-(3-bromophenyl)-2-(4-methoxy-N-(4-methyl-3-nitro-phenyl)sulfonyl-anilino)acetamide Formula: C22H20BrN3O6S MolecularWeight: 534.3797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC(=CC=C2)Br)C3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC(=CC=C2)Br)C3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H20BrN3O6S/c1-15-6-11-20(13-21(15)26(28)29)33(30,31)25(18-7-9-19(32-2)10-8-18)14-22(27)24-17-5-3-4-16(23)12-17/h3-13H,14H2,1-2H3,(H,24,27)