N-cyclopropyl-4-[[cyclopropyl-(4-methoxy-3-nitro-phenyl)sulfonyl-amino]methyl]benzamide

Systemtic Name: N-cyclopropyl-4-[[cyclopropyl-(4-methoxy-3-nitro-phenyl)sulfonyl-amino]methyl]benzamide Openeye Name: N-cyclopropyl-4-[[cyclopropyl-(4-methoxy-3-nitro-phenyl)sulfonyl-amino]methyl]benzamide CAS Name: N-cyclopropyl-4-[[cyclopropyl-(4-methoxy-3-nitrophenyl)sulfonylamino]methyl]benzamide IUPAC Name: N-cyclopropyl-4-[[cyclopropyl-(4-methoxy-3-nitrophenyl)sulfonylamino]methyl]benzamide Traditional Name: N-cyclopropyl-4-[[cyclopropyl-(4-methoxy-3-nitro-phenyl)sulfonyl-amino]methyl]benzamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC3CC3)C4CC4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC3CC3)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6S/c1-30-20-11-10-18(12-19(20)24(26)27)31(28,29)23(17-8-9-17)13-14-2-4-15(5-3-14)21(25)22-16-6-7-16/h2-5,10-12,16-17H,6-9,13H2,1H3,(H,22,25)