methyl 2-bromanyl-3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]indole-6-carboxylate

Systemtic Name: methyl 2-bromanyl-3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]indole-6-carboxylate Openeye Name: methyl 2-bromo-3-cyclohexyl-1-[2-(dimethylamino)-2-oxo-ethyl]indole-6-carboxylate CAS Name: 2-bromo-3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 2-bromo-3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]indole-6-carboxylate Traditional Name: 2-bromo-3-cyclohexyl-1-[2-(dimethylamino)-2-keto-ethyl]indole-6-carboxylic acid methyl ester Formula: C20H25BrN2O3 MolecularWeight: 421.3281

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)OC)C(=C1Br)C3CCCCC3

Isomeric SMILES

CN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)OC)C(=C1Br)C3CCCCC3

InChI

InChI=1S/C20H25BrN2O3/c1-22(2)17(24)12-23-16-11-14(20(25)26-3)9-10-15(16)18(19(23)21)13-7-5-4-6-8-13/h9-11,13H,4-8,12H2,1-3H3