methyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexyl]amino]ethanoate

Systemtic Name: methyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexyl]amino]ethanoate Openeye Name: methyl 2-[[6-(benzyloxycarbonylamino)-2-(tert-butoxycarbonylamino)hexyl]amino]acetate CAS Name: 2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-(phenylmethoxycarbonylamino)hexyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexyl]amino]acetate Traditional Name: 2-[[6-(benzyloxycarbonylamino)-2-(tert-butoxycarbonylamino)hexyl]amino]acetic acid methyl ester Formula: C22H35N3O6 MolecularWeight: 437.5298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCCNC(=O)OCC1=CC=CC=C1)CNCC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCCNC(=O)OCC1=CC=CC=C1)CNCC(=O)OC

InChI

InChI=1S/C22H35N3O6/c1-22(2,3)31-21(28)25-18(14-23-15-19(26)29-4)12-8-9-13-24-20(27)30-16-17-10-6-5-7-11-17/h5-7,10-11,18,23H,8-9,12-16H2,1-4H3,(H,24,27)(H,25,28)