diethyl 2-[6-(1-ethoxy-2-methyl-1-oxidanylidene-propan-2-yl)oxyhexyl]-2-[(4-methylphenyl)carbonylamino]propanedioate

Systemtic Name: diethyl 2-[6-(1-ethoxy-2-methyl-1-oxidanylidene-propan-2-yl)oxyhexyl]-2-[(4-methylphenyl)carbonylamino]propanedioate Openeye Name: diethyl 2-[6-(2-ethoxy-1,1-dimethyl-2-oxo-ethoxy)hexyl]-2-[(4-methylbenzoyl)amino]propanedioate CAS Name: 2-[6-(1-ethoxy-2-methyl-1-oxopropan-2-yl)oxyhexyl]-2-[[(4-methylphenyl)-oxomethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[6-(1-ethoxy-2-methyl-1-oxopropan-2-yl)oxyhexyl]-2-[(4-methylbenzoyl)amino]propanedioate Traditional Name: 2-[6-(2-ethoxy-2-keto-1,1-dimethyl-ethoxy)hexyl]-2-(p-toluoylamino)malonic acid diethyl ester Formula: C27H41NO8 MolecularWeight: 507.61634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)OCCCCCCC(C(=O)OCC)(C(=O)OCC)NC(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCOC(=O)C(C)(C)OCCCCCCC(C(=O)OCC)(C(=O)OCC)NC(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C27H41NO8/c1-7-33-23(30)26(5,6)36-19-13-11-10-12-18-27(24(31)34-8-2,25(32)35-9-3)28-22(29)21-16-14-20(4)15-17-21/h14-17H,7-13,18-19H2,1-6H3,(H,28,29)