6-bromanyl-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6-bromanyl-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 6-bromo-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one CAS Name: 6-bromo-3-[[4-[6-(4-ethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 6-bromo-3-[4-(6-p-phenetylpyridazin-3-yl)piperazine-1-carbonyl]coumarin Formula: C26H23BrN4O4 MolecularWeight: 535.38922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=CC(=C5)Br)OC4=O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=C(C=CC(=C5)Br)OC4=O

InChI

InChI=1S/C26H23BrN4O4/c1-2-34-20-6-3-17(4-7-20)22-8-10-24(29-28-22)30-11-13-31(14-12-30)25(32)21-16-18-15-19(27)5-9-23(18)35-26(21)33/h3-10,15-16H,2,11-14H2,1H3