4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[(homoveratrylamino)methyl]-6,7-dimethyl-coumarin Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNCCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNCCC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C22H25NO4/c1-14-9-18-17(12-22(24)27-20(18)10-15(14)2)13-23-8-7-16-5-6-19(25-3)21(11-16)26-4/h5-6,9-12,23H,7-8,13H2,1-4H3