2-(butoxycarbonylamino)-2-(hydroxymethyl)-3-phenylmethoxy-butanoic acid

Systemtic Name: 2-(butoxycarbonylamino)-2-(hydroxymethyl)-3-phenylmethoxy-butanoic acid Openeye Name: 3-benzyloxy-2-(butoxycarbonylamino)-2-(hydroxymethyl)butanoic acid CAS Name: 2-[[butoxy(oxo)methyl]amino]-2-(hydroxymethyl)-3-phenylmethoxybutanoic acid IUPAC Name: 2-(butoxycarbonylamino)-2-(hydroxymethyl)-3-phenylmethoxybutanoic acid Traditional Name: 3-benzoxy-2-(butoxycarbonylamino)-2-methylol-butyric acid Formula: C17H25NO6 MolecularWeight: 339.3835

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CO)(C(C)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCCOC(=O)NC(CO)(C(C)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C17H25NO6/c1-3-4-10-23-16(22)18-17(12-19,15(20)21)13(2)24-11-14-8-6-5-7-9-14/h5-9,13,19H,3-4,10-12H2,1-2H3,(H,18,22)(H,20,21)