5-[4-[(4-iodophenyl)-(3-methylbut-2-enyl)amino]piperidin-1-yl]-2-methyl-5-oxidanylidene-pentanamide

Systemtic Name: 5-[4-[(4-iodophenyl)-(3-methylbut-2-enyl)amino]piperidin-1-yl]-2-methyl-5-oxidanylidene-pentanamide Openeye Name: 5-[4-[4-iodo-N-(3-methylbut-2-enyl)anilino]-1-piperidyl]-2-methyl-5-oxo-pentanamide CAS Name: 5-[4-[4-iodo-N-(3-methylbut-2-enyl)anilino]-1-piperidinyl]-2-methyl-5-oxopentanamide IUPAC Name: 5-[4-[4-iodo-N-(3-methylbut-2-enyl)anilino]piperidin-1-yl]-2-methyl-5-oxopentanamide Traditional Name: 5-[4-[4-iodo-N-(3-methylbut-2-enyl)anilino]piperidino]-5-keto-2-methyl-valeramide Formula: C22H32IN3O2 MolecularWeight: 497.41285

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)N1CCC(CC1)N(CC=C(C)C)C2=CC=C(C=C2)I)C(=O)N

Isomeric SMILES

CC(CCC(=O)N1CCC(CC1)N(CC=C(C)C)C2=CC=C(C=C2)I)C(=O)N

InChI

InChI=1S/C22H32IN3O2/c1-16(2)10-15-26(19-7-5-18(23)6-8-19)20-11-13-25(14-12-20)21(27)9-4-17(3)22(24)28/h5-8,10,17,20H,4,9,11-15H2,1-3H3,(H2,24,28)