3-[4-[6-(2-methylphenyl)pyridazin-3-yl]piperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-[6-(2-methylphenyl)pyridazin-3-yl]piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-[6-(o-tolyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-[6-(2-methylphenyl)-3-pyridazinyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[6-(2-methylphenyl)pyridazin-3-yl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-[6-(o-tolyl)pyridazin-3-yl]piperazine-1-carbonyl]coumarin Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H22N4O3/c1-17-6-2-4-8-19(17)21-10-11-23(27-26-21)28-12-14-29(15-13-28)24(30)20-16-18-7-3-5-9-22(18)32-25(20)31/h2-11,16H,12-15H2,1H3