[1-[4-(2-methyl-2-oxidanyl-propoxy)phenyl]-5-oxidanylidene-pyrrolidin-3-yl] 2-methoxybenzoate

Systemtic Name: [1-[4-(2-methyl-2-oxidanyl-propoxy)phenyl]-5-oxidanylidene-pyrrolidin-3-yl] 2-methoxybenzoate Openeye Name: [1-[4-(2-hydroxy-2-methyl-propoxy)phenyl]-5-oxo-pyrrolidin-3-yl] 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid [1-[4-(2-hydroxy-2-methylpropoxy)phenyl]-5-oxo-3-pyrrolidinyl] ester IUPAC Name: [1-[4-(2-hydroxy-2-methylpropoxy)phenyl]-5-oxopyrrolidin-3-yl] 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid [1-[4-(2-hydroxy-2-methyl-propoxy)phenyl]-5-keto-pyrrolidin-3-yl] ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=CC=C(C=C1)N2CC(CC2=O)OC(=O)C3=CC=CC=C3OC)O

Isomeric SMILES

CC(C)(COC1=CC=C(C=C1)N2CC(CC2=O)OC(=O)C3=CC=CC=C3OC)O

InChI

InChI=1S/C22H25NO6/c1-22(2,26)14-28-16-10-8-15(9-11-16)23-13-17(12-20(23)24)29-21(25)18-6-4-5-7-19(18)27-3/h4-11,17,26H,12-14H2,1-3H3