methyl 2-(bromomethyl)-1-(phenylsulfonyl)indole-3-carboxylate

Systemtic Name: methyl 2-(bromomethyl)-1-(phenylsulfonyl)indole-3-carboxylate Openeye Name: methyl 1-(benzenesulfonyl)-2-(bromomethyl)indole-3-carboxylate CAS Name: 1-(benzenesulfonyl)-2-(bromomethyl)-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(benzenesulfonyl)-2-(bromomethyl)indole-3-carboxylate Traditional Name: 1-besyl-2-(bromomethyl)indole-3-carboxylic acid methyl ester Formula: C17H14BrNO4S MolecularWeight: 408.26636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)CBr

Isomeric SMILES

COC(=O)C1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)CBr

InChI

InChI=1S/C17H14BrNO4S/c1-23-17(20)16-13-9-5-6-10-14(13)19(15(16)11-18)24(21,22)12-7-3-2-4-8-12/h2-10H,11H2,1H3