8-(diethylaminomethyl)-3-(3,4-dimethoxyphenyl)-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 8-(diethylaminomethyl)-3-(3,4-dimethoxyphenyl)-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 8-(diethylaminomethyl)-3-(3,4-dimethoxyphenyl)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 8-(diethylaminomethyl)-3-(3,4-dimethoxyphenyl)-4-hydroxy-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 8-(diethylaminomethyl)-3-(3,4-dimethoxyphenyl)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 8-(diethylaminomethyl)-3-(3,4-dimethoxyphenyl)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1C2C(=C(C(=CO2)C3=CC(=C(C=C3)OC)OC)O)CCC1=O

Isomeric SMILES

CCN(CC)CC1C2C(=C(C(=CO2)C3=CC(=C(C=C3)OC)OC)O)CCC1=O

InChI

InChI=1S/C22H29NO5/c1-5-23(6-2)12-16-18(24)9-8-15-21(25)17(13-28-22(15)16)14-7-10-19(26-3)20(11-14)27-4/h7,10-11,13,16,22,25H,5-6,8-9,12H2,1-4H3