2-(3-bromanyl-1-adamantyl)-N-[4-[2-(3-bromanyl-1-adamantyl)ethanoylamino]-3-nitro-phenyl]ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-[4-[2-(3-bromanyl-1-adamantyl)ethanoylamino]-3-nitro-phenyl]ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[4-[[2-(3-bromo-1-adamantyl)acetyl]amino]-3-nitro-phenyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[4-[[2-(3-bromo-1-adamantyl)-1-oxoethyl]amino]-3-nitrophenyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-[4-[[2-(3-bromo-1-adamantyl)acetyl]amino]-3-nitrophenyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-[4-[[2-(3-bromo-1-adamantyl)acetyl]amino]-3-nitro-phenyl]acetamide Formula: C30H37Br2N3O4 MolecularWeight: 663.44048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NC4=CC(=C(C=C4)NC(=O)CC56CC7CC(C5)CC(C7)(C6)Br)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NC4=CC(=C(C=C4)NC(=O)CC56CC7CC(C5)CC(C7)(C6)Br)[N+](=O)[O-]

InChI

InChI=1S/C30H37Br2N3O4/c31-29-10-18-3-19(11-29)7-27(6-18,16-29)14-25(36)33-22-1-2-23(24(5-22)35(38)39)34-26(37)15-28-8-20-4-21(9-28)13-30(32,12-20)17-28/h1-2,5,18-21H,3-4,6-17H2,(H,33,36)(H,34,37)