2-[4-(5-pyrrolidin-1-ylpentoxy)phenyl]oxane-4-carbonitrile

Systemtic Name: 2-[4-(5-pyrrolidin-1-ylpentoxy)phenyl]oxane-4-carbonitrile Openeye Name: 2-[4-(5-pyrrolidin-1-ylpentoxy)phenyl]tetrahydropyran-4-carbonitrile CAS Name: 2-[4-[5-(1-pyrrolidinyl)pentoxy]phenyl]-4-oxanecarbonitrile IUPAC Name: 2-[4-(5-pyrrolidin-1-ylpentoxy)phenyl]oxane-4-carbonitrile Traditional Name: 2-[4-(5-pyrrolidinopentoxy)phenyl]tetrahydropyran-4-carbonitrile Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCCOC2=CC=C(C=C2)C3CC(CCO3)C#N

Isomeric SMILES

C1CCN(C1)CCCCCOC2=CC=C(C=C2)C3CC(CCO3)C#N

InChI

InChI=1S/C21H30N2O2/c22-17-18-10-15-25-21(16-18)19-6-8-20(9-7-19)24-14-5-1-2-11-23-12-3-4-13-23/h6-9,18,21H,1-5,10-16H2