diethyl 2-benzamido-2-[4-(2-ethoxycarbonyl-2-methyl-1,3-dioxan-5-yl)butyl]propanedioate

Systemtic Name: diethyl 2-benzamido-2-[4-(2-ethoxycarbonyl-2-methyl-1,3-dioxan-5-yl)butyl]propanedioate Openeye Name: diethyl 2-benzamido-2-[4-(2-ethoxycarbonyl-2-methyl-1,3-dioxan-5-yl)butyl]propanedioate CAS Name: 2-benzamido-2-[4-(2-ethoxycarbonyl-2-methyl-1,3-dioxan-5-yl)butyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-benzamido-2-[4-(2-ethoxycarbonyl-2-methyl-1,3-dioxan-5-yl)butyl]propanedioate Traditional Name: 2-benzamido-2-[4-(2-carbethoxy-2-methyl-1,3-dioxan-5-yl)butyl]malonic acid diethyl ester Formula: C26H37NO9 MolecularWeight: 507.57328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(OCC(CO1)CCCCC(C(=O)OCC)(C(=O)OCC)NC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1(OCC(CO1)CCCCC(C(=O)OCC)(C(=O)OCC)NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C26H37NO9/c1-5-32-22(29)25(4)35-17-19(18-36-25)13-11-12-16-26(23(30)33-6-2,24(31)34-7-3)27-21(28)20-14-9-8-10-15-20/h8-10,14-15,19H,5-7,11-13,16-18H2,1-4H3,(H,27,28)