5-(azepan-1-ylsulfonyl)-2-methoxy-N-(2-methoxy-5-nitro-phenyl)benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(2-methoxy-5-nitro-phenyl)benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(2-methoxy-5-nitro-phenyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methoxy-N-(2-methoxy-5-nitrophenyl)benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(2-methoxy-5-nitrophenyl)benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(2-methoxy-5-nitro-phenyl)benzamide Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H25N3O7S/c1-30-19-10-8-16(32(28,29)23-11-5-3-4-6-12-23)14-17(19)21(25)22-18-13-15(24(26)27)7-9-20(18)31-2/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,22,25)