2-[(2-acetamido-3-cyclohexa-1,5-dien-1-yl-propanoyl)amino]-N-[1-(dioctylamino)-1-oxidanylidene-propan-2-yl]-3-methyl-butanamide

Systemtic Name: 2-[(2-acetamido-3-cyclohexa-1,5-dien-1-yl-propanoyl)amino]-N-[1-(dioctylamino)-1-oxidanylidene-propan-2-yl]-3-methyl-butanamide Openeye Name: 2-[(2-acetamido-3-cyclohexa-1,5-dien-1-yl-propanoyl)amino]-N-[2-(dioctylamino)-1-methyl-2-oxo-ethyl]-3-methyl-butanamide CAS Name: 2-[[2-acetamido-3-(1-cyclohexa-1,5-dienyl)-1-oxopropyl]amino]-N-[1-(dioctylamino)-1-oxopropan-2-yl]-3-methylbutanamide IUPAC Name: 2-[(2-acetamido-3-cyclohexa-1,5-dien-1-ylpropanoyl)amino]-N-[1-(dioctylamino)-1-oxopropan-2-yl]-3-methylbutanamide Traditional Name: 2-[(2-acetamido-3-cyclohexa-1,5-dien-1-yl-propanoyl)amino]-N-[2-(dioctylamino)-2-keto-1-methyl-ethyl]-3-methyl-butyramide Formula: C35H62N4O4 MolecularWeight: 602.89118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)C(=O)C(C)NC(=O)C(C(C)C)NC(=O)C(CC1=CCCC=C1)NC(=O)C

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)C(=O)C(C)NC(=O)C(C(C)C)NC(=O)C(CC1=CCCC=C1)NC(=O)C

InChI

InChI=1S/C35H62N4O4/c1-7-9-11-13-15-20-24-39(25-21-16-14-12-10-8-2)35(43)28(5)36-34(42)32(27(3)4)38-33(41)31(37-29(6)40)26-30-22-18-17-19-23-30/h18,22-23,27-28,31-32H,7-17,19-21,24-26H2,1-6H3,(H,36,42)(H,37,40)(H,38,41)