ethyl 4-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]ethyl]benzoate

Systemtic Name: ethyl 4-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]ethyl]benzoate Openeye Name: ethyl 4-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]ethyl]benzoate CAS Name: 4-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]ethyl]benzoate Traditional Name: 4-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]ethyl]benzoic acid ethyl ester Formula: C28H38N2O4 MolecularWeight: 466.61232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CCN(C)CCCC(C#N)(C2=CC(=C(C=C2)OC)OC)C(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CCN(C)CCCC(C#N)(C2=CC(=C(C=C2)OC)OC)C(C)C

InChI

InChI=1S/C28H38N2O4/c1-7-34-27(31)23-11-9-22(10-12-23)15-18-30(4)17-8-16-28(20-29,21(2)3)24-13-14-25(32-5)26(19-24)33-6/h9-14,19,21H,7-8,15-18H2,1-6H3