1-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-3,3-dimethoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-3,3-dimethoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-3,3-dimethoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-3,3-dimethoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-3,3-dimethoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]-3,3-dimethoxy-proline Formula: C22H32N2O7 MolecularWeight: 436.49868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCC(C2C(=O)O)(OC)OC

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCC(C2C(=O)O)(OC)OC

InChI

InChI=1S/C22H32N2O7/c1-5-31-21(28)17(12-11-16-9-7-6-8-10-16)23-15(2)19(25)24-14-13-22(29-3,30-4)18(24)20(26)27/h6-10,15,17-18,23H,5,11-14H2,1-4H3,(H,26,27)