N-[4-[2-(3-bromanyl-1-adamantyl)ethanoylamino]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[2-(3-bromanyl-1-adamantyl)ethanoylamino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[2-(3-bromo-1-adamantyl)-1-oxoethyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]-3-methyl-butyramide Formula: C23H31BrN2O2 MolecularWeight: 447.40844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

InChI

InChI=1S/C23H31BrN2O2/c1-15(2)7-20(27)25-18-3-5-19(6-4-18)26-21(28)13-22-9-16-8-17(10-22)12-23(24,11-16)14-22/h3-6,15-17H,7-14H2,1-2H3,(H,25,27)(H,26,28)