1-[6-bromanyl-2-methyl-1-(4-methylphenyl)-5-oxidanyl-4-prop-2-enyl-indol-3-yl]ethanone

Systemtic Name: 1-[6-bromanyl-2-methyl-1-(4-methylphenyl)-5-oxidanyl-4-prop-2-enyl-indol-3-yl]ethanone Openeye Name: 1-[4-allyl-6-bromo-5-hydroxy-2-methyl-1-(p-tolyl)indol-3-yl]ethanone CAS Name: 1-[6-bromo-5-hydroxy-2-methyl-1-(4-methylphenyl)-4-prop-2-enyl-3-indolyl]ethanone IUPAC Name: 1-[6-bromo-5-hydroxy-2-methyl-1-(4-methylphenyl)-4-prop-2-enylindol-3-yl]ethanone Traditional Name: 1-[4-allyl-6-bromo-5-hydroxy-2-methyl-1-(p-tolyl)indol-3-yl]ethanone Formula: C21H20BrNO2 MolecularWeight: 398.293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C3=C(C(=C(C=C32)Br)O)CC=C)C(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C3=C(C(=C(C=C32)Br)O)CC=C)C(=O)C)C

InChI

InChI=1S/C21H20BrNO2/c1-5-6-16-20-18(11-17(22)21(16)25)23(13(3)19(20)14(4)24)15-9-7-12(2)8-10-15/h5,7-11,25H,1,6H2,2-4H3