2-oxidanyl-3-(phenylmethoxycarbonylamino)-4-(4-propan-2-yloxyphenyl)butanoic acid

Systemtic Name: 2-oxidanyl-3-(phenylmethoxycarbonylamino)-4-(4-propan-2-yloxyphenyl)butanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-2-hydroxy-4-(4-isopropoxyphenyl)butanoic acid CAS Name: 2-hydroxy-3-(phenylmethoxycarbonylamino)-4-(4-propan-2-yloxyphenyl)butanoic acid IUPAC Name: 2-hydroxy-3-(phenylmethoxycarbonylamino)-4-(4-propan-2-yloxyphenyl)butanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-2-hydroxy-4-(4-isopropoxyphenyl)butyric acid Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CC(C(C(=O)O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CC(C(C(=O)O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO6/c1-14(2)28-17-10-8-15(9-11-17)12-18(19(23)20(24)25)22-21(26)27-13-16-6-4-3-5-7-16/h3-11,14,18-19,23H,12-13H2,1-2H3,(H,22,26)(H,24,25)