3-[[1-(4-methylphenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decan-8-yl]carbonyl]benzenecarbonitrile

Systemtic Name: 3-[[1-(4-methylphenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decan-8-yl]carbonyl]benzenecarbonitrile Openeye Name: 3-[1-(p-tolylsulfonyl)-4-oxa-1,8-diazaspiro[4.5]decane-8-carbonyl]benzonitrile CAS Name: 3-[[1-(4-methylphenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decan-8-yl]-oxomethyl]benzonitrile IUPAC Name: 3-[1-(4-methylphenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decane-8-carbonyl]benzonitrile Traditional Name: 3-(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=CC(=C4)C#N

Isomeric SMILES

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

InChI

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