N-[1-[4-(3-bromophenyl)carbonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]octanamide

Systemtic Name: N-[1-[4-(3-bromophenyl)carbonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]octanamide Openeye Name: N-[1-[4-(3-bromobenzoyl)piperazine-1-carbonyl]-2-methyl-propyl]octanamide CAS Name: N-[1-[4-[(3-bromophenyl)-oxomethyl]-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]octanamide IUPAC Name: N-[1-[4-(3-bromobenzoyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]octanamide Traditional Name: N-[1-[4-(3-bromobenzoyl)piperazine-1-carbonyl]-2-methyl-propyl]caprylamide Formula: C24H36BrN3O3 MolecularWeight: 494.46494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(C(C)C)C(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CCCCCCCC(=O)NC(C(C)C)C(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C24H36BrN3O3/c1-4-5-6-7-8-12-21(29)26-22(18(2)3)24(31)28-15-13-27(14-16-28)23(30)19-10-9-11-20(25)17-19/h9-11,17-18,22H,4-8,12-16H2,1-3H3,(H,26,29)