1-[[3-benzamido-2-oxidanylidene-4-(4-phenylmethoxyphenyl)butyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[3-benzamido-2-oxidanylidene-4-(4-phenylmethoxyphenyl)butyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[3-benzamido-4-(4-benzyloxyphenyl)-2-oxo-butyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[[3-benzamido-2-oxo-4-(4-phenylmethoxyphenyl)butyl]-methylamino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[3-benzamido-2-oxo-4-(4-phenylmethoxyphenyl)butyl]-methylcarbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[3-benzamido-4-(4-benzoxyphenyl)-2-keto-butyl]-methyl-carbamoyl]proline Formula: C31H33N3O6 MolecularWeight: 543.61022

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C(=O)N4CCCC4C(=O)O

Isomeric SMILES

CN(CC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C(=O)N4CCCC4C(=O)O

InChI

InChI=1S/C31H33N3O6/c1-33(31(39)34-18-8-13-27(34)30(37)38)20-28(35)26(32-29(36)24-11-6-3-7-12-24)19-22-14-16-25(17-15-22)40-21-23-9-4-2-5-10-23/h2-7,9-12,14-17,26-27H,8,13,18-21H2,1H3,(H,32,36)(H,37,38)