2-[(diphenylmethylidene)amino]-2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]hex-4-ynoic acid

Systemtic Name: 2-[(diphenylmethylidene)amino]-2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]hex-4-ynoic acid Openeye Name: 2-(benzhydrylideneamino)-6-(tert-butoxycarbonylamino)-2-methyl-hex-4-ynoic acid CAS Name: 2-[(diphenylmethylene)amino]-2-methyl-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-hexynoic acid IUPAC Name: 2-(benzhydrylideneamino)-2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]hex-4-ynoic acid Traditional Name: 2-(benzhydrylideneamino)-6-(tert-butoxycarbonylamino)-2-methyl-hex-4-ynoic acid Formula: C25H28N2O4 MolecularWeight: 420.50082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC#CCC(C)(C(=O)O)N=C(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCC#CCC(C)(C(=O)O)N=C(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C25H28N2O4/c1-24(2,3)31-23(30)26-18-12-11-17-25(4,22(28)29)27-21(19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5-10,13-16H,17-18H2,1-4H3,(H,26,30)(H,28,29)