6-chloranyl-4-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-7-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[(4-ethoxy-3-methoxy-benzyl)-methyl-amino]methyl]-7-methyl-coumarin Formula: C22H24ClNO4 MolecularWeight: 401.88326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C)OC

InChI

InChI=1S/C22H24ClNO4/c1-5-27-19-7-6-15(9-21(19)26-4)12-24(3)13-16-10-22(25)28-20-8-14(2)18(23)11-17(16)20/h6-11H,5,12-13H2,1-4H3