4-[4-[11-(3,4-diethylpyrrolidin-1-yl)-11-oxidanylidene-undecoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[11-(3,4-diethylpyrrolidin-1-yl)-11-oxidanylidene-undecoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[11-(3,4-diethylpyrrolidin-1-yl)-11-oxo-undecoxy]phenyl]benzonitrile CAS Name: 4-[4-[11-(3,4-diethyl-1-pyrrolidinyl)-11-oxoundecoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[11-(3,4-diethylpyrrolidin-1-yl)-11-oxoundecoxy]phenyl]benzonitrile Traditional Name: 4-[4-[11-(3,4-diethylpyrrolidino)-11-keto-undecoxy]phenyl]benzonitrile Formula: C32H44N2O2 MolecularWeight: 488.70396

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC1CC)C(=O)CCCCCCCCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCC1CN(CC1CC)C(=O)CCCCCCCCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C32H44N2O2/c1-3-27-24-34(25-28(27)4-2)32(35)13-11-9-7-5-6-8-10-12-22-36-31-20-18-30(19-21-31)29-16-14-26(23-33)15-17-29/h14-21,27-28H,3-13,22,24-25H2,1-2H3