[but-3-yn-2-yl(phenoxycarbonyl)amino] 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoate

Systemtic Name: [but-3-yn-2-yl(phenoxycarbonyl)amino] 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoate Openeye Name: [1-methylprop-2-ynyl(phenoxycarbonyl)amino] 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoate CAS Name: 2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-phenylpropanoic acid [but-3-yn-2-yl-[oxo(phenoxy)methyl]amino] ester IUPAC Name: [but-3-yn-2-yl(phenoxycarbonyl)amino] 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoate Traditional Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propionic acid [carbophenoxy(1-methylprop-2-ynyl)amino] ester Formula: C35H30N2O6 MolecularWeight: 574.6225

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)N(C(=O)OC1=CC=CC=C1)OC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC(C#C)N(C(=O)OC1=CC=CC=C1)OC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C35H30N2O6/c1-3-24(2)37(35(40)42-26-16-8-5-9-17-26)43-33(38)32(22-25-14-6-4-7-15-25)36-34(39)41-23-31-29-20-12-10-18-27(29)28-19-11-13-21-30(28)31/h1,4-21,24,31-32H,22-23H2,2H3,(H,36,39)