[2-[2,2-dimethyl-4-(phenylcarbonyloxy)-3H-pyrrol-4-yl]-5,5-dimethyl-pyrrolidin-3-yl] benzoate

Systemtic Name: [2-[2,2-dimethyl-4-(phenylcarbonyloxy)-3H-pyrrol-4-yl]-5,5-dimethyl-pyrrolidin-3-yl] benzoate Openeye Name: [2-(4-benzoyloxy-2,2-dimethyl-3H-pyrrol-4-yl)-5,5-dimethyl-pyrrolidin-3-yl] benzoate CAS Name: benzoic acid [2-(4-benzoyloxy-2,2-dimethyl-3H-pyrrol-4-yl)-5,5-dimethyl-3-pyrrolidinyl] ester IUPAC Name: [2-(4-benzoyloxy-2,2-dimethyl-3H-pyrrol-4-yl)-5,5-dimethylpyrrolidin-3-yl] benzoate Traditional Name: benzoic acid [2-(3-benzoyloxy-5,5-dimethyl-1-pyrrolin-3-yl)-5,5-dimethyl-pyrrolidin-3-yl] ester Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(N1)C2(CC(N=C2)(C)C)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(C(N1)C2(CC(N=C2)(C)C)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H30N2O4/c1-24(2)15-20(31-22(29)18-11-7-5-8-12-18)21(28-24)26(16-25(3,4)27-17-26)32-23(30)19-13-9-6-10-14-19/h5-14,17,20-21,28H,15-16H2,1-4H3