3-(3,4-dimethoxyphenyl)-8-(dimethylaminomethyl)-2-methyl-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-8-(dimethylaminomethyl)-2-methyl-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 3-(3,4-dimethoxyphenyl)-8-(dimethylaminomethyl)-4-hydroxy-2-methyl-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 3-(3,4-dimethoxyphenyl)-8-(dimethylaminomethyl)-4-hydroxy-2-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-8-(dimethylaminomethyl)-4-hydroxy-2-methyl-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 3-(3,4-dimethoxyphenyl)-8-(dimethylaminomethyl)-4-hydroxy-2-methyl-5,6,8,8a-tetrahydrochromen-7-one Formula: C21H27NO5 MolecularWeight: 373.44278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CCC(=O)C(C2O1)CN(C)C)O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C(=C2CCC(=O)C(C2O1)CN(C)C)O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H27NO5/c1-12-19(13-6-9-17(25-4)18(10-13)26-5)20(24)14-7-8-16(23)15(11-22(2)3)21(14)27-12/h6,9-10,15,21,24H,7-8,11H2,1-5H3