3-[5-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]prop-2-yn-1-ol

Systemtic Name: 3-[5-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]prop-2-yn-1-ol Openeye Name: 3-[5-bromo-1-(p-tolylsulfonyl)indol-3-yl]prop-2-yn-1-ol CAS Name: 3-[5-bromo-1-(4-methylphenyl)sulfonyl-3-indolyl]-2-propyn-1-ol IUPAC Name: 3-[5-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]prop-2-yn-1-ol Traditional Name: 3-(5-bromo-1-tosyl-indol-3-yl)prop-2-yn-1-ol Formula: C18H14BrNO3S MolecularWeight: 404.27766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Br)C#CCO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Br)C#CCO

InChI

InChI=1S/C18H14BrNO3S/c1-13-4-7-16(8-5-13)24(22,23)20-12-14(3-2-10-21)17-11-15(19)6-9-18(17)20/h4-9,11-12,21H,10H2,1H3