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

Systemtic Name: 6-[(5S)-1-ethanoyl-5-(4-methoxyphenyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[(5S)-1-acetyl-5-(4-methoxyphenyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(5S)-1-acetyl-5-(4-methoxyphenyl)-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(5S)-1-acetyl-5-(4-methoxyphenyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(5S)-1-acetyl-5-(4-methoxyphenyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C18H18N2O3 MolecularWeight: 310.34712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=C2C=CC=CC2=O)N1)C3=CC=C(C=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3/c1-12(21)20-17(13-7-9-14(23-2)10-8-13)11-16(19-20)15-5-3-4-6-18(15)22/h3-10,17,19H,11H2,1-2H3/t17-/m0/s1