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

Systemtic Name: 1-[[(4-ethoxy-4-oxidanylidene-3-phenyl-butyl)amino]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[(4-ethoxy-4-oxo-3-phenyl-butyl)amino]-methyl-carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[[(4-ethoxy-4-oxo-3-phenylbutyl)amino]-methylamino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[(4-ethoxy-4-oxo-3-phenylbutyl)amino]-methylcarbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[(4-ethoxy-4-keto-3-phenyl-butyl)amino]-methyl-carbamoyl]proline Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCNN(C)C(=O)N1CCCC1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CCNN(C)C(=O)N1CCCC1C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C19H27N3O5/c1-3-27-18(25)15(14-8-5-4-6-9-14)11-12-20-21(2)19(26)22-13-7-10-16(22)17(23)24/h4-6,8-9,15-16,20H,3,7,10-13H2,1-2H3,(H,23,24)