ethyl 2-(bromomethyl)-5-methoxy-1-(phenylsulfonyl)indole-3-carboxylate

Systemtic Name: ethyl 2-(bromomethyl)-5-methoxy-1-(phenylsulfonyl)indole-3-carboxylate Openeye Name: ethyl 1-(benzenesulfonyl)-2-(bromomethyl)-5-methoxy-indole-3-carboxylate CAS Name: 1-(benzenesulfonyl)-2-(bromomethyl)-5-methoxy-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzenesulfonyl)-2-(bromomethyl)-5-methoxyindole-3-carboxylate Traditional Name: 1-besyl-2-(bromomethyl)-5-methoxy-indole-3-carboxylic acid ethyl ester Formula: C19H18BrNO5S MolecularWeight: 452.31892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3)CBr

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3)CBr

InChI

InChI=1S/C19H18BrNO5S/c1-3-26-19(22)18-15-11-13(25-2)9-10-16(15)21(17(18)12-20)27(23,24)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3