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

Systemtic Name: 6-chloranyl-4-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[homoveratryl(methyl)amino]methyl]-7-methyl-coumarin Formula: C22H24ClNO4 MolecularWeight: 401.88326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN(C)CCC3=CC(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN(C)CCC3=CC(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C22H24ClNO4/c1-14-9-20-17(12-18(14)23)16(11-22(25)28-20)13-24(2)8-7-15-5-6-19(26-3)21(10-15)27-4/h5-6,9-12H,7-8,13H2,1-4H3