2-[(2,2-dimethyl-5-oxidanylidene-oxolan-3-yl)carbonylamino]-3-(4-pyrrolidin-1-ylcarbonyloxyphenyl)propanoic acid

Systemtic Name: 2-[(2,2-dimethyl-5-oxidanylidene-oxolan-3-yl)carbonylamino]-3-(4-pyrrolidin-1-ylcarbonyloxyphenyl)propanoic acid Openeye Name: 2-[(2,2-dimethyl-5-oxo-tetrahydrofuran-3-carbonyl)amino]-3-[4-(pyrrolidine-1-carbonyloxy)phenyl]propanoic acid CAS Name: 2-[[(2,2-dimethyl-5-oxo-3-oxolanyl)-oxomethyl]amino]-3-[4-[oxo(1-pyrrolidinyl)methoxy]phenyl]propanoic acid IUPAC Name: 2-[(2,2-dimethyl-5-oxooxolane-3-carbonyl)amino]-3-[4-(pyrrolidine-1-carbonyloxy)phenyl]propanoic acid Traditional Name: 2-[(5-keto-2,2-dimethyl-tetrahydrofuran-3-carbonyl)amino]-3-[4-(pyrrolidine-1-carbonyloxy)phenyl]propionic acid Formula: C21H26N2O7 MolecularWeight: 418.44034

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC(=O)O1)C(=O)NC(CC2=CC=C(C=C2)OC(=O)N3CCCC3)C(=O)O)C

Isomeric SMILES

CC1(C(CC(=O)O1)C(=O)NC(CC2=CC=C(C=C2)OC(=O)N3CCCC3)C(=O)O)C

InChI

InChI=1S/C21H26N2O7/c1-21(2)15(12-17(24)30-21)18(25)22-16(19(26)27)11-13-5-7-14(8-6-13)29-20(28)23-9-3-4-10-23/h5-8,15-16H,3-4,9-12H2,1-2H3,(H,22,25)(H,26,27)