methyl (E)-7-(1-azanylethylideneamino)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]hept-5-enoate

Systemtic Name: methyl (E)-7-(1-azanylethylideneamino)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]hept-5-enoate Openeye Name: methyl (E)-7-(1-aminoethylideneamino)-2-[bis(tert-butoxycarbonyl)amino]hept-5-enoate CAS Name: (E)-7-(1-aminoethylideneamino)-2-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-(1-aminoethylideneamino)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]hept-5-enoate Traditional Name: (E)-7-(1-aminoethylideneamino)-2-[bis(tert-butoxycarbonyl)amino]hept-5-enoic acid methyl ester Formula: C20H35N3O6 MolecularWeight: 413.5084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC=CCCC(C(=O)OC)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N

Isomeric SMILES

CC(=NC/C=C/CCC(C(=O)OC)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C20H35N3O6/c1-14(21)22-13-11-9-10-12-15(16(24)27-8)23(17(25)28-19(2,3)4)18(26)29-20(5,6)7/h9,11,15H,10,12-13H2,1-8H3,(H2,21,22)/b11-9+