5-hexoxy-2-[3-[[1-(4-methoxyphenyl)-2-methyl-propan-2-yl]amino]propoxy]benzenecarbonitrile

Systemtic Name: 5-hexoxy-2-[3-[[1-(4-methoxyphenyl)-2-methyl-propan-2-yl]amino]propoxy]benzenecarbonitrile Openeye Name: 5-hexoxy-2-[3-[[2-(4-methoxyphenyl)-1,1-dimethyl-ethyl]amino]propoxy]benzonitrile CAS Name: 5-hexoxy-2-[3-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile IUPAC Name: 5-hexoxy-2-[3-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile Traditional Name: 5-hexoxy-2-[3-[[2-(4-methoxyphenyl)-1,1-dimethyl-ethyl]amino]propoxy]benzonitrile Formula: C27H38N2O3 MolecularWeight: 438.60222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1)OCCCNC(C)(C)CC2=CC=C(C=C2)OC)C#N

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1)OCCCNC(C)(C)CC2=CC=C(C=C2)OC)C#N

InChI

InChI=1S/C27H38N2O3/c1-5-6-7-8-17-31-25-14-15-26(23(19-25)21-28)32-18-9-16-29-27(2,3)20-22-10-12-24(30-4)13-11-22/h10-15,19,29H,5-9,16-18,20H2,1-4H3