1-azanyl-2-[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-azanyl-2-[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]cyclopropane-1-carboxylic acid Openeye Name: 1-amino-2-[2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]cyclopropanecarboxylic acid CAS Name: 1-amino-2-[3-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-amino-2-[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]cyclopropane-1-carboxylic acid Traditional Name: 1-amino-2-[2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]cyclopropanecarboxylic acid Formula: C18H24N2O6 MolecularWeight: 364.39296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)C2CC2(C(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)C2CC2(C(=O)O)N

InChI

InChI=1S/C18H24N2O6/c1-17(2,3)26-16(25)20-13(8-10-4-6-11(21)7-5-10)14(22)12-9-18(12,19)15(23)24/h4-7,12-13,21H,8-9,19H2,1-3H3,(H,20,25)(H,23,24)