N-[4-(1-adamantylmethylamino)-3-nitro-phenyl]sulfonyl-4-(1H-indol-6-yl)benzamide

Systemtic Name: N-[4-(1-adamantylmethylamino)-3-nitro-phenyl]sulfonyl-4-(1H-indol-6-yl)benzamide Openeye Name: N-[4-(1-adamantylmethylamino)-3-nitro-phenyl]sulfonyl-4-(1H-indol-6-yl)benzamide CAS Name: N-[4-(1-adamantylmethylamino)-3-nitrophenyl]sulfonyl-4-(1H-indol-6-yl)benzamide IUPAC Name: N-[4-(1-adamantylmethylamino)-3-nitrophenyl]sulfonyl-4-(1H-indol-6-yl)benzamide Traditional Name: N-[4-(1-adamantylmethylamino)-3-nitro-phenyl]sulfonyl-4-(1H-indol-6-yl)benzamide Formula: C32H32N4O5S MolecularWeight: 584.68528

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC4=C(C=C(C=C4)S(=O)(=O)NC(=O)C5=CC=C(C=C5)C6=CC7=C(C=C6)C=CN7)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC4=C(C=C(C=C4)S(=O)(=O)NC(=O)C5=CC=C(C=C5)C6=CC7=C(C=C6)C=CN7)[N+](=O)[O-]

InChI

InChI=1S/C32H32N4O5S/c37-31(25-4-1-23(2-5-25)26-6-3-24-9-10-33-29(24)14-26)35-42(40,41)27-7-8-28(30(15-27)36(38)39)34-19-32-16-20-11-21(17-32)13-22(12-20)18-32/h1-10,14-15,20-22,33-34H,11-13,16-19H2,(H,35,37)