3-(1,3-benzodioxol-4-yl)-N-tert-butyl-N-[3-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]octanamide

Systemtic Name: 3-(1,3-benzodioxol-4-yl)-N-tert-butyl-N-[3-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]octanamide Openeye Name: 3-(1,3-benzodioxol-4-yl)-N-tert-butyl-N-[3-[2-(methylamino)-2-oxo-ethyl]phenyl]octanamide CAS Name: 3-(1,3-benzodioxol-4-yl)-N-tert-butyl-N-[3-[2-(methylamino)-2-oxoethyl]phenyl]octanamide IUPAC Name: 3-(1,3-benzodioxol-4-yl)-N-tert-butyl-N-[3-[2-(methylamino)-2-oxoethyl]phenyl]octanamide Traditional Name: 3-(1,3-benzodioxol-4-yl)-N-tert-butyl-N-[3-[2-keto-2-(methylamino)ethyl]phenyl]caprylamide Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)N(C1=CC=CC(=C1)CC(=O)NC)C(C)(C)C)C2=C3C(=CC=C2)OCO3

Isomeric SMILES

CCCCCC(CC(=O)N(C1=CC=CC(=C1)CC(=O)NC)C(C)(C)C)C2=C3C(=CC=C2)OCO3

InChI

InChI=1S/C28H38N2O4/c1-6-7-8-12-21(23-14-10-15-24-27(23)34-19-33-24)18-26(32)30(28(2,3)4)22-13-9-11-20(16-22)17-25(31)29-5/h9-11,13-16,21H,6-8,12,17-19H2,1-5H3,(H,29,31)