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

Systemtic Name: propyl 3-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]ethyl]benzoate Openeye Name: propyl 3-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]ethyl]benzoate CAS Name: 3-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]ethyl]benzoic acid propyl ester IUPAC Name: propyl 3-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]ethyl]benzoate Traditional Name: 3-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]ethyl]benzoic acid propyl ester Formula: C29H40N2O4 MolecularWeight: 480.6389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H40N2O4/c1-7-18-35-28(32)24-11-8-10-23(19-24)14-17-31(4)16-9-15-29(21-30,22(2)3)25-12-13-26(33-5)27(20-25)34-6/h8,10-13,19-20,22H,7,9,14-18H2,1-6H3