6-[(5S)-5-phenyl-1-propanoyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(5S)-5-phenyl-1-propanoyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[(5S)-5-phenyl-1-propanoyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(5S)-1-(1-oxopropyl)-5-phenyl-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(5S)-5-phenyl-1-propanoylpyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(5S)-5-phenyl-1-propionyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=C2C=CC=CC2=O)N1)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1[C@@H](CC(=C2C=CC=CC2=O)N1)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O2/c1-2-18(22)20-16(13-8-4-3-5-9-13)12-15(19-20)14-10-6-7-11-17(14)21/h3-11,16,19H,2,12H2,1H3/t16-/m0/s1