3-[1-(4-tert-butylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxycarbonyl-benzoic acid

Systemtic Name: 3-[1-(4-tert-butylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxycarbonyl-benzoic acid Openeye Name: 3-[1-(4-tert-butylphenyl)-5-oxo-pyrrolidin-3-yl]-2-methoxycarbonyl-benzoic acid CAS Name: 3-[1-(4-tert-butylphenyl)-5-oxo-3-pyrrolidinyl]-2-methoxycarbonylbenzoic acid IUPAC Name: 3-[1-(4-tert-butylphenyl)-5-oxopyrrolidin-3-yl]-2-methoxycarbonylbenzoic acid Traditional Name: 3-[1-(4-tert-butylphenyl)-5-keto-pyrrolidin-3-yl]-2-carbomethoxy-benzoic acid Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CC(CC2=O)C3=CC=CC(=C3C(=O)OC)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CC(CC2=O)C3=CC=CC(=C3C(=O)OC)C(=O)O

InChI

InChI=1S/C23H25NO5/c1-23(2,3)15-8-10-16(11-9-15)24-13-14(12-19(24)25)17-6-5-7-18(21(26)27)20(17)22(28)29-4/h5-11,14H,12-13H2,1-4H3,(H,26,27)