methyl 3-(4-hydroxyphenyl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]propanoate

Systemtic Name: methyl 3-(4-hydroxyphenyl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]propanoate Openeye Name: methyl 2-[2-(tert-butoxycarbonylamino)hexanoylamino]-3-(4-hydroxyphenyl)propanoate CAS Name: 3-(4-hydroxyphenyl)-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-hydroxyphenyl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]propanoate Traditional Name: 2-[2-(tert-butoxycarbonylamino)hexanoylamino]-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H32N2O6/c1-6-7-8-16(23-20(27)29-21(2,3)4)18(25)22-17(19(26)28-5)13-14-9-11-15(24)12-10-14/h9-12,16-17,24H,6-8,13H2,1-5H3,(H,22,25)(H,23,27)