[(2S,3S)-2-(3-bromanyl-4-methoxy-phenyl)-6-methoxy-4-oxidanylidene-2,3-dihydrochromen-3-yl] N-(2-phenoxyethyl)carbamate

Systemtic Name: [(2S,3S)-2-(3-bromanyl-4-methoxy-phenyl)-6-methoxy-4-oxidanylidene-2,3-dihydrochromen-3-yl] N-(2-phenoxyethyl)carbamate Openeye Name: [(2S,3S)-2-(3-bromo-4-methoxy-phenyl)-6-methoxy-4-oxo-chroman-3-yl] N-(2-phenoxyethyl)carbamate CAS Name: N-(2-phenoxyethyl)carbamic acid [(2S,3S)-2-(3-bromo-4-methoxyphenyl)-6-methoxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(2S,3S)-2-(3-bromo-4-methoxyphenyl)-6-methoxy-4-oxo-2,3-dihydrochromen-3-yl] N-(2-phenoxyethyl)carbamate Traditional Name: N-(2-phenoxyethyl)carbamic acid [(2S,3S)-2-(3-bromo-4-methoxy-phenyl)-4-keto-6-methoxy-chroman-3-yl] ester Formula: C26H24BrNO7 MolecularWeight: 542.37526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(C(C2=O)OC(=O)NCCOC3=CC=CC=C3)C4=CC(=C(C=C4)OC)Br

Isomeric SMILES

COC1=CC2=C(C=C1)O[C@H]([C@@H](C2=O)OC(=O)NCCOC3=CC=CC=C3)C4=CC(=C(C=C4)OC)Br

InChI

InChI=1S/C26H24BrNO7/c1-31-18-9-11-21-19(15-18)23(29)25(24(34-21)16-8-10-22(32-2)20(27)14-16)35-26(30)28-12-13-33-17-6-4-3-5-7-17/h3-11,14-15,24-25H,12-13H2,1-2H3,(H,28,30)/t24-,25+/m0/s1