N-[4-(cyclohexylmethylamino)-3-nitro-phenyl]sulfonyl-4-(2-methoxyphenyl)benzamide

Systemtic Name: N-[4-(cyclohexylmethylamino)-3-nitro-phenyl]sulfonyl-4-(2-methoxyphenyl)benzamide Openeye Name: N-[4-(cyclohexylmethylamino)-3-nitro-phenyl]sulfonyl-4-(2-methoxyphenyl)benzamide CAS Name: N-[4-(cyclohexylmethylamino)-3-nitrophenyl]sulfonyl-4-(2-methoxyphenyl)benzamide IUPAC Name: N-[4-(cyclohexylmethylamino)-3-nitrophenyl]sulfonyl-4-(2-methoxyphenyl)benzamide Traditional Name: N-[4-(cyclohexylmethylamino)-3-nitro-phenyl]sulfonyl-4-(2-methoxyphenyl)benzamide Formula: C27H29N3O6S MolecularWeight: 523.60066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC=C(C=C2)C(=O)NS(=O)(=O)C3=CC(=C(C=C3)NCC4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C2=CC=C(C=C2)C(=O)NS(=O)(=O)C3=CC(=C(C=C3)NCC4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C27H29N3O6S/c1-36-26-10-6-5-9-23(26)20-11-13-21(14-12-20)27(31)29-37(34,35)22-15-16-24(25(17-22)30(32)33)28-18-19-7-3-2-4-8-19/h5-6,9-17,19,28H,2-4,7-8,18H2,1H3,(H,29,31)