4-[4-[[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]methyl]piperidin-4-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-[[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]methyl]piperidin-4-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-[[4-(4,5-dihydrooxazol-2-yl)phenyl]methyl]piperidine-4-carbonyl]benzonitrile CAS Name: 4-[[4-[[4-(4,5-dihydrooxazol-2-yl)phenyl]methyl]-4-piperidinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-[[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]methyl]piperidine-4-carbonyl]benzonitrile Traditional Name: 4-[4-[4-(2-oxazolin-2-yl)benzyl]isonipecotoyl]benzonitrile Formula: C23H23N3O2 MolecularWeight: 373.44762

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(CC2=CC=C(C=C2)C3=NCCO3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CNCCC1(CC2=CC=C(C=C2)C3=NCCO3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H23N3O2/c24-16-18-3-5-19(6-4-18)21(27)23(9-11-25-12-10-23)15-17-1-7-20(8-2-17)22-26-13-14-28-22/h1-8,25H,9-15H2