1-[2-[(3-carboxyphenyl)carbamoylamino]ethanoyl]-5-phenyl-pyrrolidine-2,4-dicarboxylate

Systemtic Name: 1-[2-[(3-carboxyphenyl)carbamoylamino]ethanoyl]-5-phenyl-pyrrolidine-2,4-dicarboxylate Openeye Name: 1-[2-[(3-carboxyphenyl)carbamoylamino]acetyl]-5-phenyl-pyrrolidine-2,4-dicarboxylate CAS Name: 1-[2-[[(3-carboxyanilino)-oxomethyl]amino]-1-oxoethyl]-5-phenylpyrrolidine-2,4-dicarboxylate IUPAC Name: 1-[2-[(3-carboxyphenyl)carbamoylamino]acetyl]-5-phenylpyrrolidine-2,4-dicarboxylate Traditional Name: 1-[2-[(3-carboxyphenyl)carbamoylamino]acetyl]-5-phenyl-pyrrolidine-2,4-dicarboxylate Formula: C22H19N3O8-2 MolecularWeight: 453.40156

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N(C1C(=O)[O-])C(=O)CNC(=O)NC2=CC=CC(=C2)C(=O)O)C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1C(C(N(C1C(=O)[O-])C(=O)CNC(=O)NC2=CC=CC(=C2)C(=O)O)C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C22H21N3O8/c26-17(11-23-22(33)24-14-8-4-7-13(9-14)19(27)28)25-16(21(31)32)10-15(20(29)30)18(25)12-5-2-1-3-6-12/h1-9,15-16,18H,10-11H2,(H,27,28)(H,29,30)(H,31,32)(H2,23,24,33)/p-2