4-[(E)-indol-3-ylidenemethyl]-5-(1H-pyrrol-2-yl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(E)-indol-3-ylidenemethyl]-5-(1H-pyrrol-2-yl)-1,2-dihydropyrazol-3-one Openeye Name: 4-[(E)-indol-3-ylidenemethyl]-5-(1H-pyrrol-2-yl)-1,2-dihydropyrazol-3-one CAS Name: 4-[(E)-3-indolylidenemethyl]-5-(1H-pyrrol-2-yl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(E)-indol-3-ylidenemethyl]-5-(1H-pyrrol-2-yl)-1,2-dihydropyrazol-3-one Traditional Name: 4-[(E)-indol-3-ylidenemethyl]-5-(1H-pyrrol-2-yl)-3-pyrazolin-3-one Formula: C16H12N4O MolecularWeight: 276.29268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC3=C(NNC3=O)C4=CC=CN4)C=N2

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C\C3=C(NNC3=O)C4=CC=CN4)/C=N2

InChI

InChI=1S/C16H12N4O/c21-16-12(15(19-20-16)14-6-3-7-17-14)8-10-9-18-13-5-2-1-4-11(10)13/h1-9,17H,(H2,19,20,21)/b10-8-