methyl 3-(furan-2-yl)-2-oxidanylidene-6-(phenylsulfonyl)-4,5-dihydro-1H-azepino[4,5-b]indole-5-carboxylate

Systemtic Name: methyl 3-(furan-2-yl)-2-oxidanylidene-6-(phenylsulfonyl)-4,5-dihydro-1H-azepino[4,5-b]indole-5-carboxylate Openeye Name: methyl 6-(benzenesulfonyl)-3-(2-furyl)-2-oxo-4,5-dihydro-1H-azepino[4,5-b]indole-5-carboxylate CAS Name: 6-(benzenesulfonyl)-3-(2-furanyl)-2-oxo-4,5-dihydro-1H-azepino[4,5-b]indole-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(benzenesulfonyl)-3-(furan-2-yl)-2-oxo-4,5-dihydro-1H-azepino[4,5-b]indole-5-carboxylate Traditional Name: 6-besyl-3-(2-furyl)-2-keto-4,5-dihydro-1H-azepin[4,5-b]indole-5-carboxylic acid methyl ester Formula: C24H20N2O6S MolecularWeight: 464.4904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(C(=O)CC2=C1N(C3=CC=CC=C23)S(=O)(=O)C4=CC=CC=C4)C5=CC=CO5

Isomeric SMILES

COC(=O)C1CN(C(=O)CC2=C1N(C3=CC=CC=C23)S(=O)(=O)C4=CC=CC=C4)C5=CC=CO5

InChI

InChI=1S/C24H20N2O6S/c1-31-24(28)19-15-25(22-12-7-13-32-22)21(27)14-18-17-10-5-6-11-20(17)26(23(18)19)33(29,30)16-8-3-2-4-9-16/h2-13,19H,14-15H2,1H3