6,8-bis(bromanyl)-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6,8-bis(bromanyl)-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 6,8-dibromo-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one CAS Name: 6,8-dibromo-3-[[4-[6-(4-ethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 6,8-dibromo-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 6,8-dibromo-3-[4-(6-p-phenetylpyridazin-3-yl)piperazine-1-carbonyl]coumarin Formula: C26H22Br2N4O4 MolecularWeight: 614.28528

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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=CC(=CC(=C5OC4=O)Br)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=CC(=CC(=C5OC4=O)Br)Br

InChI

InChI=1S/C26H22Br2N4O4/c1-2-35-19-5-3-16(4-6-19)22-7-8-23(30-29-22)31-9-11-32(12-10-31)25(33)20-14-17-13-18(27)15-21(28)24(17)36-26(20)34/h3-8,13-15H,2,9-12H2,1H3