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

Systemtic Name: 7-bromanyl-4-[[methyl-[2-(4-methylphenoxy)ethyl]amino]methyl]chromen-2-one Openeye Name: 7-bromo-4-[[methyl-[2-(4-methylphenoxy)ethyl]amino]methyl]chromen-2-one CAS Name: 7-bromo-4-[[methyl-[2-(4-methylphenoxy)ethyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[methyl-[2-(4-methylphenoxy)ethyl]amino]methyl]chromen-2-one Traditional Name: 7-bromo-4-[[methyl-[2-(4-methylphenoxy)ethyl]amino]methyl]coumarin Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN(C)CC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)OCCN(C)CC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

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