3-[3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoyl]-2-phenyl-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoyl]-2-phenyl-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[2-(benzyloxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]-2-phenyl-thiazolidine-4-carboxylic acid CAS Name: 3-[3-(4-hydroxyphenyl)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]-2-phenyl-4-thiazolidinecarboxylic acid IUPAC Name: 3-[3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoyl]-2-phenyl-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[2-(benzyloxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]-2-phenyl-thiazolidine-4-carboxylic acid Formula: C27H26N2O6S MolecularWeight: 506.57014

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(S1)C2=CC=CC=C2)C(=O)C(CC3=CC=C(C=C3)O)NC(=O)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C(N(C(S1)C2=CC=CC=C2)C(=O)C(CC3=CC=C(C=C3)O)NC(=O)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H26N2O6S/c30-21-13-11-18(12-14-21)15-22(28-27(34)35-16-19-7-3-1-4-8-19)24(31)29-23(26(32)33)17-36-25(29)20-9-5-2-6-10-20/h1-14,22-23,25,30H,15-17H2,(H,28,34)(H,32,33)