(phenylmethyl) 2-(2,3,4-trimethoxyphenyl)carbonylpyrazolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(2,3,4-trimethoxyphenyl)carbonylpyrazolidine-1-carboxylate Openeye Name: benzyl 2-(2,3,4-trimethoxybenzoyl)pyrazolidine-1-carboxylate CAS Name: 2-[oxo-(2,3,4-trimethoxyphenyl)methyl]-1-pyrazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2,3,4-trimethoxybenzoyl)pyrazolidine-1-carboxylate Traditional Name: 2-(2,3,4-trimethoxybenzoyl)pyrazolidine-1-carboxylic acid benzyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)N2CCCN2C(=O)OCC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)N2CCCN2C(=O)OCC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C21H24N2O6/c1-26-17-11-10-16(18(27-2)19(17)28-3)20(24)22-12-7-13-23(22)21(25)29-14-15-8-5-4-6-9-15/h4-6,8-11H,7,12-14H2,1-3H3