[4-(3-phenoxyphenyl)but-3-yn-2-yl-phenylmethoxycarbonyl-amino] (phenylmethyl) carbonate

Systemtic Name: [4-(3-phenoxyphenyl)but-3-yn-2-yl-phenylmethoxycarbonyl-amino] (phenylmethyl) carbonate Openeye Name: benzyl [benzyloxycarbonyl-[1-methyl-3-(3-phenoxyphenyl)prop-2-ynyl]amino] carbonate CAS Name: carbonic acid [4-(3-phenoxyphenyl)but-3-yn-2-yl-phenylmethoxycarbonylamino] (phenylmethyl) ester IUPAC Name: benzyl [4-(3-phenoxyphenyl)but-3-yn-2-yl-phenylmethoxycarbonylamino] carbonate Traditional Name: carbonic acid benzyl [carbobenzoxy-[1-methyl-3-(3-phenoxyphenyl)prop-2-ynyl]amino] ester Formula: C32H27NO6 MolecularWeight: 521.55988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC(=CC=C1)OC2=CC=CC=C2)N(C(=O)OCC3=CC=CC=C3)OC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C#CC1=CC(=CC=C1)OC2=CC=CC=C2)N(C(=O)OCC3=CC=CC=C3)OC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H27NO6/c1-25(20-21-26-16-11-19-30(22-26)38-29-17-9-4-10-18-29)33(31(34)36-23-27-12-5-2-6-13-27)39-32(35)37-24-28-14-7-3-8-15-28/h2-19,22,25H,23-24H2,1H3