5-(3-phenylpropyl)-4-[(Z)-pyrrol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-(3-phenylpropyl)-4-[(Z)-pyrrol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-(3-phenylpropyl)-4-[(Z)-pyrrol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one CAS Name: 5-(3-phenylpropyl)-4-[(Z)-2-pyrrolylidenemethyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-(3-phenylpropyl)-4-[(Z)-pyrrol-2-ylidenemethyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-(3-phenylpropyl)-4-[(Z)-pyrrol-2-ylidenemethyl]-3-pyrazolin-3-one Formula: C17H17N3O MolecularWeight: 279.33638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=C(C(=O)NN2)C=C3C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=C(C(=O)NN2)/C=C\3/C=CC=N3

InChI

InChI=1S/C17H17N3O/c21-17-15(12-14-9-5-11-18-14)16(19-20-17)10-4-8-13-6-2-1-3-7-13/h1-3,5-7,9,11-12H,4,8,10H2,(H2,19,20,21)/b14-12-