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

Systemtic Name: 8-ethoxy-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 8-ethoxy-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one CAS Name: 8-ethoxy-3-[[4-[6-(4-ethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 8-ethoxy-3-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 8-ethoxy-3-[4-(6-p-phenetylpyridazin-3-yl)piperazine-1-carbonyl]coumarin Formula: C28H28N4O5 MolecularWeight: 500.54572

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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)OCC)OC4=O

Isomeric SMILES

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

InChI

InChI=1S/C28H28N4O5/c1-3-35-21-10-8-19(9-11-21)23-12-13-25(30-29-23)31-14-16-32(17-15-31)27(33)22-18-20-6-5-7-24(36-4-2)26(20)37-28(22)34/h5-13,18H,3-4,14-17H2,1-2H3