(phenylmethyl) 3,3-bis[(2-azanyl-3-phenyl-propanoyl)oxy]-1-(phenylmethyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 3,3-bis[(2-azanyl-3-phenyl-propanoyl)oxy]-1-(phenylmethyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: benzyl 3,3-bis[(2-amino-3-phenyl-propanoyl)oxy]-1-benzylsulfonyl-pyrrolidine-2-carboxylate CAS Name: 3,3-bis(2-amino-1-oxo-3-phenylpropoxy)-1-(phenylmethyl)sulfonyl-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3,3-bis[(2-amino-3-phenylpropanoyl)oxy]-1-benzylsulfonylpyrrolidine-2-carboxylate Traditional Name: 1-benzylsulfonyl-3,3-diphenylalanyloxy-pyrrolidine-2-carboxylic acid benzyl ester Formula: C37H39N3O8S MolecularWeight: 685.78586

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1(OC(=O)C(CC2=CC=CC=C2)N)OC(=O)C(CC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(C(C1(OC(=O)C(CC2=CC=CC=C2)N)OC(=O)C(CC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C37H39N3O8S/c38-31(23-27-13-5-1-6-14-27)34(41)47-37(48-35(42)32(39)24-28-15-7-2-8-16-28)21-22-40(49(44,45)26-30-19-11-4-12-20-30)33(37)36(43)46-25-29-17-9-3-10-18-29/h1-20,31-33H,21-26,38-39H2