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

Systemtic Name: 1-[[3-(2-methoxyethoxycarbonylamino)-2-oxidanylidene-4-phenyl-butyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[3-(2-methoxyethoxycarbonylamino)-2-oxo-4-phenyl-butyl]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[[3-[[2-methoxyethoxy(oxo)methyl]amino]-2-oxo-4-phenylbutyl]-methylamino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[3-(2-methoxyethoxycarbonylamino)-2-oxo-4-phenylbutyl]-methylcarbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[2-keto-3-(2-methoxyethoxycarbonylamino)-4-phenyl-butyl]-methyl-carbamoyl]proline Formula: C21H29N3O7 MolecularWeight: 435.47086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O7/c1-23(21(29)24-10-6-9-17(24)19(26)27)14-18(25)16(13-15-7-4-3-5-8-15)22-20(28)31-12-11-30-2/h3-5,7-8,16-17H,6,9-14H2,1-2H3,(H,22,28)(H,26,27)