9-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]fluorene-9-carbonitrile; ethanedioate

Systemtic Name: 9-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]fluorene-9-carbonitrile; ethanedioate Openeye Name: 9-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]fluorene-9-carbonitrile; oxalate CAS Name: 9-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propyl]-9-fluorenecarbonitrile; oxalate IUPAC Name: 9-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propyl]fluorene-9-carbonitrile; oxalate Traditional Name: 9-[3-[homoveratryl(methyl)amino]propyl]fluorene-9-carbonitrile; oxalate Formula: C30H30N2O6-2 MolecularWeight: 514.569

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1(C2=CC=CC=C2C3=CC=CC=C31)C#N)CCC4=CC(=C(C=C4)OC)OC.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CN(CCCC1(C2=CC=CC=C2C3=CC=CC=C31)C#N)CCC4=CC(=C(C=C4)OC)OC.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C28H30N2O2.C2H2O4/c1-30(18-15-21-13-14-26(31-2)27(19-21)32-3)17-8-16-28(20-29)24-11-6-4-9-22(24)23-10-5-7-12-25(23)28;3-1(4)2(5)6/h4-7,9-14,19H,8,15-18H2,1-3H3;(H,3,4)(H,5,6)/p-2