[(2S,3S)-6-bromanyl-2-(3-methoxyphenyl)-4-oxidanylidene-2,3-dihydrochromen-3-yl] N-(furan-2-ylmethyl)carbamate

Systemtic Name: [(2S,3S)-6-bromanyl-2-(3-methoxyphenyl)-4-oxidanylidene-2,3-dihydrochromen-3-yl] N-(furan-2-ylmethyl)carbamate Openeye Name: [(2S,3S)-6-bromo-2-(3-methoxyphenyl)-4-oxo-chroman-3-yl] N-(2-furylmethyl)carbamate CAS Name: N-(2-furanylmethyl)carbamic acid [(2S,3S)-6-bromo-2-(3-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(2S,3S)-6-bromo-2-(3-methoxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl] N-(furan-2-ylmethyl)carbamate Traditional Name: N-(2-furfuryl)carbamic acid [(2S,3S)-6-bromo-4-keto-2-(3-methoxyphenyl)chroman-3-yl] ester Formula: C22H18BrNO6 MolecularWeight: 472.28542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C(=O)C3=C(O2)C=CC(=C3)Br)OC(=O)NCC4=CC=CO4

Isomeric SMILES

COC1=CC=CC(=C1)[C@H]2[C@@H](C(=O)C3=C(O2)C=CC(=C3)Br)OC(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H18BrNO6/c1-27-15-5-2-4-13(10-15)20-21(30-22(26)24-12-16-6-3-9-28-16)19(25)17-11-14(23)7-8-18(17)29-20/h2-11,20-21H,12H2,1H3,(H,24,26)/t20-,21+/m0/s1