2-[[4-tert-butyl-3-(3-methoxypropoxy)phenyl]methyl]-5-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoic acid

Systemtic Name: 2-[[4-tert-butyl-3-(3-methoxypropoxy)phenyl]methyl]-5-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-2-[[4-tert-butyl-3-(3-methoxypropoxy)phenyl]methyl]-5-methyl-heptanoic acid CAS Name: 2-[[4-tert-butyl-3-(3-methoxypropoxy)phenyl]methyl]-5-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]heptanoic acid IUPAC Name: 2-[[4-tert-butyl-3-(3-methoxypropoxy)phenyl]methyl]-5-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-2-[4-tert-butyl-3-(3-methoxypropoxy)benzyl]-5-methyl-enanthic acid Formula: C28H47NO6 MolecularWeight: 493.67588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCC(CC1=CC(=C(C=C1)C(C)(C)C)OCCCOC)(C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)CCC(CC1=CC(=C(C=C1)C(C)(C)C)OCCCOC)(C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H47NO6/c1-10-20(2)14-15-28(24(30)31,29-25(32)35-27(6,7)8)19-21-12-13-22(26(3,4)5)23(18-21)34-17-11-16-33-9/h12-13,18,20H,10-11,14-17,19H2,1-9H3,(H,29,32)(H,30,31)