methyl (E)-3-[3-(bromomethyl)-1-(phenylsulfonyl)indol-2-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-(bromomethyl)-1-(phenylsulfonyl)indol-2-yl]prop-2-enoate Openeye Name: methyl (E)-3-[1-(benzenesulfonyl)-3-(bromomethyl)indol-2-yl]prop-2-enoate CAS Name: (E)-3-[1-(benzenesulfonyl)-3-(bromomethyl)-2-indolyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[1-(benzenesulfonyl)-3-(bromomethyl)indol-2-yl]prop-2-enoate Traditional Name: (E)-3-[1-besyl-3-(bromomethyl)indol-2-yl]acrylic acid methyl ester Formula: C19H16BrNO4S MolecularWeight: 434.30364

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=C(C2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3)CBr

Isomeric SMILES

COC(=O)/C=C/C1=C(C2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3)CBr

InChI

InChI=1S/C19H16BrNO4S/c1-25-19(22)12-11-18-16(13-20)15-9-5-6-10-17(15)21(18)26(23,24)14-7-3-2-4-8-14/h2-12H,13H2,1H3/b12-11+