(phenylmethyl) 8-[2-aminocarbonyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]octanoate

Systemtic Name: (phenylmethyl) 8-[2-aminocarbonyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]octanoate Openeye Name: benzyl 8-[2-(tert-butoxycarbonylamino)-6-carbamoyl-phenyl]octanoate CAS Name: 8-[2-carbamoyl-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]octanoic acid (phenylmethyl) ester IUPAC Name: benzyl 8-[2-carbamoyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]octanoate Traditional Name: 8-[2-(tert-butoxycarbonylamino)-6-carbamoyl-phenyl]caprylic acid benzyl ester Formula: C27H36N2O5 MolecularWeight: 468.58514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1CCCCCCCC(=O)OCC2=CC=CC=C2)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1CCCCCCCC(=O)OCC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C27H36N2O5/c1-27(2,3)34-26(32)29-23-17-12-16-22(25(28)31)21(23)15-10-5-4-6-11-18-24(30)33-19-20-13-8-7-9-14-20/h7-9,12-14,16-17H,4-6,10-11,15,18-19H2,1-3H3,(H2,28,31)(H,29,32)