2-[5-chloranyl-3-[2-(oxan-2-yloxy)ethylsulfonyl]indol-1-yl]ethanenitrile

Systemtic Name: 2-[5-chloranyl-3-[2-(oxan-2-yloxy)ethylsulfonyl]indol-1-yl]ethanenitrile Openeye Name: 2-[5-chloro-3-(2-tetrahydropyran-2-yloxyethylsulfonyl)indol-1-yl]acetonitrile CAS Name: 2-[5-chloro-3-[2-(2-oxanyloxy)ethylsulfonyl]-1-indolyl]acetonitrile IUPAC Name: 2-[5-chloro-3-[2-(oxan-2-yloxy)ethylsulfonyl]indol-1-yl]acetonitrile Traditional Name: 2-[5-chloro-3-(2-tetrahydropyran-2-yloxyethylsulfonyl)indol-1-yl]acetonitrile Formula: C17H19ClN2O4S MolecularWeight: 382.86176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCCS(=O)(=O)C2=CN(C3=C2C=C(C=C3)Cl)CC#N

Isomeric SMILES

C1CCOC(C1)OCCS(=O)(=O)C2=CN(C3=C2C=C(C=C3)Cl)CC#N

InChI

InChI=1S/C17H19ClN2O4S/c18-13-4-5-15-14(11-13)16(12-20(15)7-6-19)25(21,22)10-9-24-17-3-1-2-8-23-17/h4-5,11-12,17H,1-3,7-10H2