4-[4-[3-[bis(phenylmethyl)amino]-2-oxidanyl-propoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[3-[bis(phenylmethyl)amino]-2-oxidanyl-propoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[3-(dibenzylamino)-2-hydroxy-propoxy]phenyl]benzonitrile CAS Name: 4-[4-[3-[bis(phenylmethyl)amino]-2-hydroxypropoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[3-(dibenzylamino)-2-hydroxypropoxy]phenyl]benzonitrile Traditional Name: 4-[4-[3-(dibenzylamino)-2-hydroxy-propoxy]phenyl]benzonitrile Formula: C30H28N2O2 MolecularWeight: 448.55552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)CC(COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)CC(COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)O

InChI

InChI=1S/C30H28N2O2/c31-19-24-11-13-27(14-12-24)28-15-17-30(18-16-28)34-23-29(33)22-32(20-25-7-3-1-4-8-25)21-26-9-5-2-6-10-26/h1-18,29,33H,20-23H2