methyl 9-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-8-oxidanylidene-3,5,6,7-tetrahydro-2H-carbazole-2-carboxylate

Systemtic Name: methyl 9-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-8-oxidanylidene-3,5,6,7-tetrahydro-2H-carbazole-2-carboxylate Openeye Name: methyl 9-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-8-oxo-3,5,6,7-tetrahydro-2H-carbazole-2-carboxylate CAS Name: 9-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-8-oxo-3,5,6,7-tetrahydro-2H-carbazole-2-carboxylic acid methyl ester IUPAC Name: methyl 9-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-8-oxo-3,5,6,7-tetrahydro-2H-carbazole-2-carboxylate Traditional Name: 9-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-8-keto-3,5,6,7-tetrahydro-2H-carbazole-2-carboxylic acid methyl ester Formula: C22H20ClNO5 MolecularWeight: 413.8509

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=C2C3=C(C(=O)CCC3)N(C2=C1)CC4=CC5=C(C=C4Cl)OCO5

Isomeric SMILES

COC(=O)C1CC=C2C3=C(C(=O)CCC3)N(C2=C1)CC4=CC5=C(C=C4Cl)OCO5

InChI

InChI=1S/C22H20ClNO5/c1-27-22(26)12-5-6-14-15-3-2-4-18(25)21(15)24(17(14)7-12)10-13-8-19-20(9-16(13)23)29-11-28-19/h6-9,12H,2-5,10-11H2,1H3