[3-(dimethylaminomethyl)-4-(3-methoxyphenyl)-4-oxidanyl-cyclohexyl] 3,4-dimethoxybenzoate

Systemtic Name: [3-(dimethylaminomethyl)-4-(3-methoxyphenyl)-4-oxidanyl-cyclohexyl] 3,4-dimethoxybenzoate Openeye Name: [3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl] ester IUPAC Name: [3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl] ester Formula: C25H33NO6 MolecularWeight: 443.53262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CC(CCC1(C2=CC(=CC=C2)OC)O)OC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(C)CC1CC(CCC1(C2=CC(=CC=C2)OC)O)OC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H33NO6/c1-26(2)16-19-15-21(11-12-25(19,28)18-7-6-8-20(14-18)29-3)32-24(27)17-9-10-22(30-4)23(13-17)31-5/h6-10,13-14,19,21,28H,11-12,15-16H2,1-5H3