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

Systemtic Name: 3,3-bis[(2-azanyl-3-phenyl-propanoyl)oxy]-1-(phenylmethyl)sulfonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3,3-bis[(2-amino-3-phenyl-propanoyl)oxy]-1-benzylsulfonyl-pyrrolidine-2-carboxylic acid CAS Name: 3,3-bis(2-amino-1-oxo-3-phenylpropoxy)-1-(phenylmethyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 3,3-bis[(2-amino-3-phenylpropanoyl)oxy]-1-benzylsulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-benzylsulfonyl-3,3-diphenylalanyloxy-proline Formula: C30H33N3O8S MolecularWeight: 595.66332

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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)O)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(C(C1(OC(=O)C(CC2=CC=CC=C2)N)OC(=O)C(CC3=CC=CC=C3)N)C(=O)O)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C30H33N3O8S/c31-24(18-21-10-4-1-5-11-21)28(36)40-30(41-29(37)25(32)19-22-12-6-2-7-13-22)16-17-33(26(30)27(34)35)42(38,39)20-23-14-8-3-9-15-23/h1-15,24-26H,16-20,31-32H2,(H,34,35)