3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-7-(diethylamino)-4-methyl-chromen-2-one

Systemtic Name: 3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-7-(diethylamino)-4-methyl-chromen-2-one Openeye Name: 3-[2-(4-bromophenyl)-2-oxo-ethyl]-7-(diethylamino)-4-methyl-chromen-2-one CAS Name: 3-[2-(4-bromophenyl)-2-oxoethyl]-7-(diethylamino)-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[2-(4-bromophenyl)-2-oxoethyl]-7-(diethylamino)-4-methylchromen-2-one Traditional Name: 3-[2-(4-bromophenyl)-2-keto-ethyl]-7-(diethylamino)-4-methyl-coumarin Formula: C22H22BrNO3 MolecularWeight: 428.31898

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)CC(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)CC(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C22H22BrNO3/c1-4-24(5-2)17-10-11-18-14(3)19(22(26)27-21(18)12-17)13-20(25)15-6-8-16(23)9-7-15/h6-12H,4-5,13H2,1-3H3