diethyl 2-[2-acetamido-3-(3-undecoxyphenyl)propyl]propanedioate

Systemtic Name: diethyl 2-[2-acetamido-3-(3-undecoxyphenyl)propyl]propanedioate Openeye Name: diethyl 2-[2-acetamido-3-(3-undecoxyphenyl)propyl]propanedioate CAS Name: 2-[2-acetamido-3-(3-undecoxyphenyl)propyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-acetamido-3-(3-undecoxyphenyl)propyl]propanedioate Traditional Name: 2-[2-acetamido-3-(3-undecoxyphenyl)propyl]malonic acid diethyl ester Formula: C29H47NO6 MolecularWeight: 505.68658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CC=CC(=C1)CC(CC(C(=O)OCC)C(=O)OCC)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCOC1=CC=CC(=C1)CC(CC(C(=O)OCC)C(=O)OCC)NC(=O)C

InChI

InChI=1S/C29H47NO6/c1-5-8-9-10-11-12-13-14-15-19-36-26-18-16-17-24(21-26)20-25(30-23(4)31)22-27(28(32)34-6-2)29(33)35-7-3/h16-18,21,25,27H,5-15,19-20,22H2,1-4H3,(H,30,31)