methyl (Z,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-7-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonyl-amino]hept-2-enoate

Systemtic Name: methyl (Z,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-7-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonyl-amino]hept-2-enoate Openeye Name: methyl (Z,4S)-7-[benzyloxycarbonyl(tert-butoxycarbonyl)amino]-4-(tert-butoxycarbonylamino)hept-2-enoate CAS Name: (Z,4S)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-7-[[(2-methylpropan-2-yl)oxy-oxomethyl]-phenylmethoxycarbonylamino]-2-heptenoic acid methyl ester IUPAC Name: methyl (Z,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-7-[(2-methylpropan-2-yl)oxycarbonyl-phenylmethoxycarbonylamino]hept-2-enoate Traditional Name: (Z,4S)-4-(tert-butoxycarbonylamino)-7-[tert-butoxycarbonyl(carbobenzoxy)amino]hept-2-enoic acid methyl ester Formula: C26H38N2O8 MolecularWeight: 506.58852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCN(C(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C)C=CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCN(C(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C)/C=C\C(=O)OC

InChI

InChI=1S/C26H38N2O8/c1-25(2,3)35-22(30)27-20(15-16-21(29)33-7)14-11-17-28(24(32)36-26(4,5)6)23(31)34-18-19-12-9-8-10-13-19/h8-10,12-13,15-16,20H,11,14,17-18H2,1-7H3,(H,27,30)/b16-15-/t20-/m0/s1