2-[5-chloranyl-2-(2-methoxyethyl)-3-methylsulfonyl-indol-1-yl]ethanenitrile

Systemtic Name: 2-[5-chloranyl-2-(2-methoxyethyl)-3-methylsulfonyl-indol-1-yl]ethanenitrile Openeye Name: 2-[5-chloro-2-(2-methoxyethyl)-3-methylsulfonyl-indol-1-yl]acetonitrile CAS Name: 2-[5-chloro-2-(2-methoxyethyl)-3-methylsulfonyl-1-indolyl]acetonitrile IUPAC Name: 2-[5-chloro-2-(2-methoxyethyl)-3-methylsulfonylindol-1-yl]acetonitrile Traditional Name: 2-[5-chloro-3-mesyl-2-(2-methoxyethyl)indol-1-yl]acetonitrile Formula: C14H15ClN2O3S MolecularWeight: 326.7985

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Descriptors Computed from Structure

Canonical SMILES:

COCCC1=C(C2=C(N1CC#N)C=CC(=C2)Cl)S(=O)(=O)C

Isomeric SMILES

COCCC1=C(C2=C(N1CC#N)C=CC(=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C14H15ClN2O3S/c1-20-8-5-13-14(21(2,18)19)11-9-10(15)3-4-12(11)17(13)7-6-16/h3-4,9H,5,7-8H2,1-2H3