4-[(9-pyrazin-2-ylcarbonyl-3,9-diazaspiro[5.5]undecan-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(9-pyrazin-2-ylcarbonyl-3,9-diazaspiro[5.5]undecan-3-yl)methyl]benzenecarbonitrile Openeye Name: 4-[[9-(pyrazine-2-carbonyl)-3,9-diazaspiro[5.5]undecan-3-yl]methyl]benzonitrile CAS Name: 4-[[9-[oxo(2-pyrazinyl)methyl]-3,9-diazaspiro[5.5]undecan-3-yl]methyl]benzonitrile IUPAC Name: 4-[[9-(pyrazine-2-carbonyl)-3,9-diazaspiro[5.5]undecan-3-yl]methyl]benzonitrile Traditional Name: 4-[(9-pyrazinoyl-3,9-diazaspiro[5.5]undecan-3-yl)methyl]benzonitrile Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CCN(CC2)C(=O)C3=NC=CN=C3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC12CCN(CC2)C(=O)C3=NC=CN=C3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H25N5O/c23-15-18-1-3-19(4-2-18)17-26-11-5-22(6-12-26)7-13-27(14-8-22)21(28)20-16-24-9-10-25-20/h1-4,9-10,16H,5-8,11-14,17H2