4-[[1-(4-methylphenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decan-8-yl]carbonyl]benzenecarbonitrile

Systemtic Name: 4-[[1-(4-methylphenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decan-8-yl]carbonyl]benzenecarbonitrile Openeye Name: 4-[1-(p-tolylsulfonyl)-4-oxa-1,8-diazaspiro[4.5]decane-8-carbonyl]benzonitrile CAS Name: 4-[[1-(4-methylphenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decan-8-yl]-oxomethyl]benzonitrile IUPAC Name: 4-[1-(4-methylphenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decane-8-carbonyl]benzonitrile Traditional Name: 4-(1-tosyl-4-oxa-1,8-diazaspiro[4.5]decane-8-carbonyl)benzonitrile Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCOC23CCN(CC3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCOC23CCN(CC3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H23N3O4S/c1-17-2-8-20(9-3-17)30(27,28)25-14-15-29-22(25)10-12-24(13-11-22)21(26)19-6-4-18(16-23)5-7-19/h2-9H,10-15H2,1H3