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

Systemtic Name: 6-chloranyl-4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[(homoveratrylamino)methyl]-7-methyl-coumarin Formula: C21H22ClNO4 MolecularWeight: 387.85668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNCCC3=CC(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNCCC3=CC(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C21H22ClNO4/c1-13-8-19-16(11-17(13)22)15(10-21(24)27-19)12-23-7-6-14-4-5-18(25-2)20(9-14)26-3/h4-5,8-11,23H,6-7,12H2,1-3H3