4-methoxycarbonyl-1-[(4-methylphenyl)carbamoyl]-5-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-methoxycarbonyl-1-[(4-methylphenyl)carbamoyl]-5-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-methoxycarbonyl-1-(p-tolylcarbamoyl)-5-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-methoxycarbonyl-1-[(4-methylanilino)-oxomethyl]-5-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-methoxycarbonyl-1-[(4-methylphenyl)carbamoyl]-5-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-carbomethoxy-1-(p-tolylcarbamoyl)-5-(2-thienyl)proline Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2C(CC(C2C3=CC=CS3)C(=O)OC)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2C(CC(C2C3=CC=CS3)C(=O)OC)C(=O)O

InChI

InChI=1S/C19H20N2O5S/c1-11-5-7-12(8-6-11)20-19(25)21-14(17(22)23)10-13(18(24)26-2)16(21)15-4-3-9-27-15/h3-9,13-14,16H,10H2,1-2H3,(H,20,25)(H,22,23)