phenacyl (3R)-1-[(3,4-dimethoxyphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: phenacyl (3R)-1-[(3,4-dimethoxyphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: phenacyl (3R)-1-[(3,4-dimethoxybenzoyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-5-oxo-3-pyrrolidinecarboxylic acid phenacyl ester IUPAC Name: phenacyl (3R)-1-[(3,4-dimethoxybenzoyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-(veratroylamino)pyrrolidine-3-carboxylic acid phenacyl ester Formula: C22H22N2O7 MolecularWeight: 426.41928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NN2CC(CC2=O)C(=O)OCC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NN2C[C@@H](CC2=O)C(=O)OCC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H22N2O7/c1-29-18-9-8-15(10-19(18)30-2)21(27)23-24-12-16(11-20(24)26)22(28)31-13-17(25)14-6-4-3-5-7-14/h3-10,16H,11-13H2,1-2H3,(H,23,27)/t16-/m1/s1