1-[2-[(3-methoxycarbonylphenyl)carbamoylamino]ethanoyl]-5-phenyl-4-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(3-methoxycarbonylphenyl)carbamoylamino]ethanoyl]-5-phenyl-4-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(3-methoxycarbonylphenyl)carbamoylamino]acetyl]-5-phenyl-4-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[anilino(oxo)methyl]-1-[2-[[(3-methoxycarbonylanilino)-oxomethyl]amino]-1-oxoethyl]-5-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(3-methoxycarbonylphenyl)carbamoylamino]acetyl]-5-phenyl-4-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(3-carbomethoxyphenyl)carbamoylamino]acetyl]-5-phenyl-4-(phenylcarbamoyl)proline Formula: C29H28N4O7 MolecularWeight: 544.55522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)NCC(=O)N2C(CC(C2C3=CC=CC=C3)C(=O)NC4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)NCC(=O)N2C(CC(C2C3=CC=CC=C3)C(=O)NC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H28N4O7/c1-40-28(38)19-11-8-14-21(15-19)32-29(39)30-17-24(34)33-23(27(36)37)16-22(25(33)18-9-4-2-5-10-18)26(35)31-20-12-6-3-7-13-20/h2-15,22-23,25H,16-17H2,1H3,(H,31,35)(H,36,37)(H2,30,32,39)