(2S)-2-[[(2S)-2-methyloxolan-2-yl]carbonylamino]-3-(4-piperidin-1-ylcarbonyloxyphenyl)propanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-methyloxolan-2-yl]carbonylamino]-3-(4-piperidin-1-ylcarbonyloxyphenyl)propanoic acid Openeye Name: (2S)-2-[[(2S)-2-methyltetrahydrofuran-2-carbonyl]amino]-3-[4-(piperidine-1-carbonyloxy)phenyl]propanoic acid CAS Name: (2S)-2-[[[(2S)-2-methyl-2-oxolanyl]-oxomethyl]amino]-3-[4-[oxo(1-piperidinyl)methoxy]phenyl]propanoic acid IUPAC Name: (2S)-2-[[(2S)-2-methyloxolane-2-carbonyl]amino]-3-[4-(piperidine-1-carbonyloxy)phenyl]propanoic acid Traditional Name: (2S)-2-[[(2S)-2-methyltetrahydrofuran-2-carbonyl]amino]-3-[4-(piperidine-1-carbonyloxy)phenyl]propionic acid Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCO1)C(=O)NC(CC2=CC=C(C=C2)OC(=O)N3CCCCC3)C(=O)O

Isomeric SMILES

C[C@]1(CCCO1)C(=O)N[C@@H](CC2=CC=C(C=C2)OC(=O)N3CCCCC3)C(=O)O

InChI

InChI=1S/C21H28N2O6/c1-21(10-5-13-28-21)19(26)22-17(18(24)25)14-15-6-8-16(9-7-15)29-20(27)23-11-3-2-4-12-23/h6-9,17H,2-5,10-14H2,1H3,(H,22,26)(H,24,25)/t17-,21-/m0/s1