1-[2-[(3-methylphenyl)carbamoylamino]ethanoyl]-5-phenyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(3-methylphenyl)carbamoylamino]ethanoyl]-5-phenyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(m-tolylcarbamoylamino)acetyl]-5-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[(3-methylanilino)-oxomethyl]amino]-1-oxoethyl]-5-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(3-methylphenyl)carbamoylamino]acetyl]-5-phenylpyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(m-tolylcarbamoylamino)acetyl]-5-phenyl-proline Formula: C21H23N3O4 MolecularWeight: 381.42502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCC(=O)N2C(CCC2C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCC(=O)N2C(CCC2C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4/c1-14-6-5-9-16(12-14)23-21(28)22-13-19(25)24-17(10-11-18(24)20(26)27)15-7-3-2-4-8-15/h2-9,12,17-18H,10-11,13H2,1H3,(H,26,27)(H2,22,23,28)