4-[4-(3-oxidanylpyrrolidin-1-yl)sulfonylphenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(3-oxidanylpyrrolidin-1-yl)sulfonylphenyl]benzenecarbonitrile Openeye Name: 4-[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]benzonitrile CAS Name: 4-[4-[(3-hydroxy-1-pyrrolidinyl)sulfonyl]phenyl]benzonitrile IUPAC Name: 4-[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]benzonitrile Traditional Name: 4-[4-(3-hydroxypyrrolidino)sulfonylphenyl]benzonitrile Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CC1O)S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H16N2O3S/c18-11-13-1-3-14(4-2-13)15-5-7-17(8-6-15)23(21,22)19-10-9-16(20)12-19/h1-8,16,20H,9-10,12H2