1-(3,3-dimethylbutanoyl)-4-methoxycarbonyl-2,3-dimethyl-5-(3-methylphenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3,3-dimethylbutanoyl)-4-methoxycarbonyl-2,3-dimethyl-5-(3-methylphenyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(3,3-dimethylbutanoyl)-4-methoxycarbonyl-2,3-dimethyl-5-(m-tolyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(3,3-dimethyl-1-oxobutyl)-4-methoxycarbonyl-2,3-dimethyl-5-(3-methylphenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3,3-dimethylbutanoyl)-4-methoxycarbonyl-2,3-dimethyl-5-(3-methylphenyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-carbomethoxy-1-(3,3-dimethylbutanoyl)-2,3-dimethyl-5-(m-tolyl)proline Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(N(C1(C)C(=O)O)C(=O)CC(C)(C)C)C2=CC(=CC=C2)C)C(=O)OC

Isomeric SMILES

CC1C(C(N(C1(C)C(=O)O)C(=O)CC(C)(C)C)C2=CC(=CC=C2)C)C(=O)OC

InChI

InChI=1S/C22H31NO5/c1-13-9-8-10-15(11-13)18-17(19(25)28-7)14(2)22(6,20(26)27)23(18)16(24)12-21(3,4)5/h8-11,14,17-18H,12H2,1-7H3,(H,26,27)