phenyl N-[1,6-bis(oxidanyl)-6-(phenoxycarbonylamino)hexa-2,4-diynyl]carbamate

Systemtic Name: phenyl N-[1,6-bis(oxidanyl)-6-(phenoxycarbonylamino)hexa-2,4-diynyl]carbamate Openeye Name: phenyl N-[1,6-dihydroxy-6-(phenoxycarbonylamino)hexa-2,4-diynyl]carbamate CAS Name: N-[1,6-dihydroxy-6-[[oxo(phenoxy)methyl]amino]hexa-2,4-diynyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[1,6-dihydroxy-6-(phenoxycarbonylamino)hexa-2,4-diynyl]carbamate Traditional Name: N-[6-(carbophenoxyamino)-1,6-dihydroxy-hexa-2,4-diynyl]carbamic acid phenyl ester Formula: C20H16N2O6 MolecularWeight: 380.35084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)NC(C#CC#CC(NC(=O)OC2=CC=CC=C2)O)O

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)NC(C#CC#CC(NC(=O)OC2=CC=CC=C2)O)O

InChI

InChI=1S/C20H16N2O6/c23-17(21-19(25)27-15-9-3-1-4-10-15)13-7-8-14-18(24)22-20(26)28-16-11-5-2-6-12-16/h1-6,9-12,17-18,23-24H,(H,21,25)(H,22,26)