(phenylmethyl) 3-[(4-methoxy-2-oxidanyl-3-propan-2-yloxy-phenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate

Systemtic Name: (phenylmethyl) 3-[(4-methoxy-2-oxidanyl-3-propan-2-yloxy-phenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate Openeye Name: benzyl 3-[tert-butoxycarbonyl-[(2-hydroxy-3-isopropoxy-4-methoxy-phenyl)methyl]amino]propanoate CAS Name: 3-[(2-hydroxy-4-methoxy-3-propan-2-yloxyphenyl)methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(2-hydroxy-4-methoxy-3-propan-2-yloxyphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate Traditional Name: 3-[tert-butoxycarbonyl-(2-hydroxy-3-isopropoxy-4-methoxy-benzyl)amino]propionic acid benzyl ester Formula: C26H35NO7 MolecularWeight: 473.5586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1O)CN(CCC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C)OC

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1O)CN(CCC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C)OC

InChI

InChI=1S/C26H35NO7/c1-18(2)33-24-21(31-6)13-12-20(23(24)29)16-27(25(30)34-26(3,4)5)15-14-22(28)32-17-19-10-8-7-9-11-19/h7-13,18,29H,14-17H2,1-6H3