4-[[9-(4-methoxyphenyl)carbonyl-3,9-diazaspiro[5.5]undecan-3-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[9-(4-methoxyphenyl)carbonyl-3,9-diazaspiro[5.5]undecan-3-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[9-(4-methoxybenzoyl)-3,9-diazaspiro[5.5]undecan-3-yl]methyl]benzonitrile CAS Name: 4-[[9-[(4-methoxyphenyl)-oxomethyl]-3,9-diazaspiro[5.5]undecan-3-yl]methyl]benzonitrile IUPAC Name: 4-[[9-(4-methoxybenzoyl)-3,9-diazaspiro[5.5]undecan-3-yl]methyl]benzonitrile Traditional Name: 4-[(9-p-anisoyl-3,9-diazaspiro[5.5]undecan-3-yl)methyl]benzonitrile Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCC3(CCN(CC3)CC4=CC=C(C=C4)C#N)CC2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCC3(CCN(CC3)CC4=CC=C(C=C4)C#N)CC2

InChI

InChI=1S/C25H29N3O2/c1-30-23-8-6-22(7-9-23)24(29)28-16-12-25(13-17-28)10-14-27(15-11-25)19-21-4-2-20(18-26)3-5-21/h2-9H,10-17,19H2,1H3