4-[[2-(4-bromanylphenoxy)ethyl-methyl-amino]methyl]-7-methyl-chromen-2-one

Systemtic Name: 4-[[2-(4-bromanylphenoxy)ethyl-methyl-amino]methyl]-7-methyl-chromen-2-one Openeye Name: 4-[[2-(4-bromophenoxy)ethyl-methyl-amino]methyl]-7-methyl-chromen-2-one CAS Name: 4-[[2-(4-bromophenoxy)ethyl-methylamino]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[[2-(4-bromophenoxy)ethyl-methylamino]methyl]-7-methylchromen-2-one Traditional Name: 4-[[2-(4-bromophenoxy)ethyl-methyl-amino]methyl]-7-methyl-coumarin Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN(C)CCOC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN(C)CCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrNO3/c1-14-3-8-18-15(12-20(23)25-19(18)11-14)13-22(2)9-10-24-17-6-4-16(21)5-7-17/h3-8,11-12H,9-10,13H2,1-2H3