4-[(3-propyl-9-azaspiro[5.5]undecan-9-yl)carbonyl]benzenecarbonitrile

Systemtic Name: 4-[(3-propyl-9-azaspiro[5.5]undecan-9-yl)carbonyl]benzenecarbonitrile Openeye Name: 4-(3-propyl-9-azaspiro[5.5]undecane-9-carbonyl)benzonitrile CAS Name: 4-[oxo-(3-propyl-9-azaspiro[5.5]undecan-9-yl)methyl]benzonitrile IUPAC Name: 4-(3-propyl-9-azaspiro[5.5]undecane-9-carbonyl)benzonitrile Traditional Name: 4-(3-propyl-9-azaspiro[5.5]undecane-9-carbonyl)benzonitrile Formula: C21H28N2O MolecularWeight: 324.45982

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2(CC1)CCN(CC2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCC1CCC2(CC1)CCN(CC2)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H28N2O/c1-2-3-17-8-10-21(11-9-17)12-14-23(15-13-21)20(24)19-6-4-18(16-22)5-7-19/h4-7,17H,2-3,8-15H2,1H3