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

Systemtic Name: 1-[[3-(methoxycarbonylamino)-2-oxidanylidene-4-phenyl-butyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[3-(methoxycarbonylamino)-2-oxo-4-phenyl-butyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[[3-(methoxycarbonylamino)-2-oxo-4-phenylbutyl]-methylamino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[3-(methoxycarbonylamino)-2-oxo-4-phenylbutyl]-methylcarbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[3-(carbomethoxyamino)-2-keto-4-phenyl-butyl]-methyl-carbamoyl]proline Formula: C19H25N3O6 MolecularWeight: 391.4183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)C(CC1=CC=CC=C1)NC(=O)OC)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CN(CC(=O)C(CC1=CC=CC=C1)NC(=O)OC)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C19H25N3O6/c1-21(19(27)22-10-6-9-15(22)17(24)25)12-16(23)14(20-18(26)28-2)11-13-7-4-3-5-8-13/h3-5,7-8,14-15H,6,9-12H2,1-2H3,(H,20,26)(H,24,25)