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

Systemtic Name: 4-methoxycarbonyl-2,3-dimethyl-1-(3-methylbutanoyl)-5-(3-methylphenyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-methoxycarbonyl-2,3-dimethyl-1-(3-methylbutanoyl)-5-(m-tolyl)pyrrolidine-2-carboxylic acid CAS Name: 4-methoxycarbonyl-2,3-dimethyl-1-(3-methyl-1-oxobutyl)-5-(3-methylphenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-methoxycarbonyl-2,3-dimethyl-1-(3-methylbutanoyl)-5-(3-methylphenyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-carbomethoxy-1-isovaleryl-2,3-dimethyl-5-(m-tolyl)proline Formula: C21H29NO5 MolecularWeight: 375.45866

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C21H29NO5/c1-12(2)10-16(23)22-18(15-9-7-8-13(3)11-15)17(19(24)27-6)14(4)21(22,5)20(25)26/h7-9,11-12,14,17-18H,10H2,1-6H3,(H,25,26)