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

Systemtic Name: [(2S,3S)-2-(3-bromanyl-4-methoxy-phenyl)-6-methoxy-4-oxidanylidene-2,3-dihydrochromen-3-yl] N-cyclopentylcarbamate Openeye Name: [(2S,3S)-2-(3-bromo-4-methoxy-phenyl)-6-methoxy-4-oxo-chroman-3-yl] N-cyclopentylcarbamate CAS Name: N-cyclopentylcarbamic 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-cyclopentylcarbamate Traditional Name: N-cyclopentylcarbamic acid [(2S,3S)-2-(3-bromo-4-methoxy-phenyl)-4-keto-6-methoxy-chroman-3-yl] ester Formula: C23H24BrNO6 MolecularWeight: 490.34376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(C(C2=O)OC(=O)NC3CCCC3)C4=CC(=C(C=C4)OC)Br

Isomeric SMILES

COC1=CC2=C(C=C1)O[C@H]([C@@H](C2=O)OC(=O)NC3CCCC3)C4=CC(=C(C=C4)OC)Br

InChI

InChI=1S/C23H24BrNO6/c1-28-15-8-10-18-16(12-15)20(26)22(31-23(27)25-14-5-3-4-6-14)21(30-18)13-7-9-19(29-2)17(24)11-13/h7-12,14,21-22H,3-6H2,1-2H3,(H,25,27)/t21-,22+/m0/s1