3-[4-[4-[4-(methoxymethyl)phenyl]phenoxy]piperidin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-[4-[4-(methoxymethyl)phenyl]phenoxy]piperidin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-[4-[4-(methoxymethyl)phenyl]phenoxy]piperidine-1-carbonyl]benzonitrile CAS Name: 3-[[4-[4-[4-(methoxymethyl)phenyl]phenoxy]-1-piperidinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-[4-[4-(methoxymethyl)phenyl]phenoxy]piperidine-1-carbonyl]benzonitrile Traditional Name: 3-[4-[4-[4-(methoxymethyl)phenyl]phenoxy]piperidine-1-carbonyl]benzonitrile Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCN(CC3)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

COCC1=CC=C(C=C1)C2=CC=C(C=C2)OC3CCN(CC3)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H26N2O3/c1-31-19-20-5-7-22(8-6-20)23-9-11-25(12-10-23)32-26-13-15-29(16-14-26)27(30)24-4-2-3-21(17-24)18-28/h2-12,17,26H,13-16,19H2,1H3