4-[(E)-indol-3-ylidenemethyl]-5-[1-(4-methylphenyl)ethyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(E)-indol-3-ylidenemethyl]-5-[1-(4-methylphenyl)ethyl]-1,2-dihydropyrazol-3-one Openeye Name: 4-[(E)-indol-3-ylidenemethyl]-5-[1-(p-tolyl)ethyl]-1,2-dihydropyrazol-3-one CAS Name: 4-[(E)-3-indolylidenemethyl]-5-[1-(4-methylphenyl)ethyl]-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(E)-indol-3-ylidenemethyl]-5-[1-(4-methylphenyl)ethyl]-1,2-dihydropyrazol-3-one Traditional Name: 4-[(E)-indol-3-ylidenemethyl]-5-[1-(p-tolyl)ethyl]-3-pyrazolin-3-one Formula: C21H19N3O MolecularWeight: 329.39506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)C2=C(C(=O)NN2)C=C3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)C(C)C2=C(C(=O)NN2)/C=C\3/C=NC4=CC=CC=C43

InChI

InChI=1S/C21H19N3O/c1-13-7-9-15(10-8-13)14(2)20-18(21(25)24-23-20)11-16-12-22-19-6-4-3-5-17(16)19/h3-12,14H,1-2H3,(H2,23,24,25)/b16-11-