[(E,1R,2R)-1-(4-methoxy-3-oxidanyl-phenyl)-7-(oxidanylamino)-7-oxidanylidene-2-phenoxy-hept-5-enyl] N-phenylcarbamate

Systemtic Name: [(E,1R,2R)-1-(4-methoxy-3-oxidanyl-phenyl)-7-(oxidanylamino)-7-oxidanylidene-2-phenoxy-hept-5-enyl] N-phenylcarbamate Openeye Name: [(E,1R,2R)-7-(hydroxyamino)-1-(3-hydroxy-4-methoxy-phenyl)-7-oxo-2-phenoxy-hept-5-enyl] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [(E,1R,2R)-7-(hydroxyamino)-1-(3-hydroxy-4-methoxyphenyl)-7-oxo-2-phenoxyhept-5-enyl] ester IUPAC Name: [(E,1R,2R)-7-(hydroxyamino)-1-(3-hydroxy-4-methoxyphenyl)-7-oxo-2-phenoxyhept-5-enyl] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [(E,1R,2R)-7-(hydroxyamino)-1-(3-hydroxy-4-methoxy-phenyl)-7-keto-2-phenoxy-hept-5-enyl] ester Formula: C27H28N2O7 MolecularWeight: 492.52042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(CCC=CC(=O)NO)OC2=CC=CC=C2)OC(=O)NC3=CC=CC=C3)O

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]([C@@H](CC/C=C/C(=O)NO)OC2=CC=CC=C2)OC(=O)NC3=CC=CC=C3)O

InChI

InChI=1S/C27H28N2O7/c1-34-23-17-16-19(18-22(23)30)26(36-27(32)28-20-10-4-2-5-11-20)24(14-8-9-15-25(31)29-33)35-21-12-6-3-7-13-21/h2-7,9-13,15-18,24,26,30,33H,8,14H2,1H3,(H,28,32)(H,29,31)/b15-9+/t24-,26-/m1/s1