[3-(dimethylaminomethyl)-4-(3-methoxyphenyl)-4-oxidanyl-cyclohexyl] 4-methoxybenzoate

Systemtic Name: [3-(dimethylaminomethyl)-4-(3-methoxyphenyl)-4-oxidanyl-cyclohexyl] 4-methoxybenzoate Openeye Name: [3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl] ester IUPAC Name: [3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl] ester Formula: C24H31NO5 MolecularWeight: 413.50664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31NO5/c1-25(2)16-19-15-22(30-23(26)17-8-10-20(28-3)11-9-17)12-13-24(19,27)18-6-5-7-21(14-18)29-4/h5-11,14,19,22,27H,12-13,15-16H2,1-4H3