3-[3-[heptyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propoxy]-2-phenyl-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[3-[heptyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propoxy]-2-phenyl-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[3-[tert-butoxycarbonyl(heptyl)amino]propoxy]-2-isopropoxy-2-phenyl-propanoic acid CAS Name: 3-[3-[heptyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propoxy]-2-phenyl-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-[heptyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propoxy]-2-phenyl-2-propan-2-yloxypropanoic acid Traditional Name: 3-[3-[tert-butoxycarbonyl(heptyl)amino]propoxy]-2-isopropoxy-2-phenyl-propionic acid Formula: C27H45NO6 MolecularWeight: 479.6493

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCOCC(C1=CC=CC=C1)(C(=O)O)OC(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCN(CCCOCC(C1=CC=CC=C1)(C(=O)O)OC(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H45NO6/c1-7-8-9-10-14-18-28(25(31)34-26(4,5)6)19-15-20-32-21-27(24(29)30,33-22(2)3)23-16-12-11-13-17-23/h11-13,16-17,22H,7-10,14-15,18-21H2,1-6H3,(H,29,30)