[4-(hydroxymethyl)-3-(2-methylpropoxy)-5-phenyl-pentan-2-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-propanoate

Systemtic Name: [4-(hydroxymethyl)-3-(2-methylpropoxy)-5-phenyl-pentan-2-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-propanoate Openeye Name: (3-benzyl-4-hydroxy-2-isobutoxy-1-methyl-butyl) 3-benzyloxy-2-(tert-butoxycarbonylamino)propanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylmethoxypropanoic acid [4-(hydroxymethyl)-3-(2-methylpropoxy)-5-phenylpentan-2-yl] ester IUPAC Name: [4-benzyl-5-hydroxy-3-(2-methylpropoxy)pentan-2-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxypropanoate Traditional Name: 3-benzoxy-2-(tert-butoxycarbonylamino)propionic acid (3-benzyl-4-hydroxy-2-isobutoxy-1-methyl-butyl) ester Formula: C31H45NO7 MolecularWeight: 543.6915

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(C(C)OC(=O)C(COCC1=CC=CC=C1)NC(=O)OC(C)(C)C)C(CC2=CC=CC=C2)CO

Isomeric SMILES

CC(C)COC(C(C)OC(=O)C(COCC1=CC=CC=C1)NC(=O)OC(C)(C)C)C(CC2=CC=CC=C2)CO

InChI

InChI=1S/C31H45NO7/c1-22(2)19-37-28(26(18-33)17-24-13-9-7-10-14-24)23(3)38-29(34)27(32-30(35)39-31(4,5)6)21-36-20-25-15-11-8-12-16-25/h7-16,22-23,26-28,33H,17-21H2,1-6H3,(H,32,35)