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

Systemtic Name: (6E)-6-[(5S)-5-[(E)-2-phenylethenyl]-1-propanoyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[(5S)-1-propanoyl-5-[(E)-styryl]pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(5S)-1-(1-oxopropyl)-5-[(E)-2-phenylethenyl]-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(5S)-5-[(E)-2-phenylethenyl]-1-propanoylpyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[(5S)-1-propionyl-5-[(E)-styryl]pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=C2C=CC=CC2=O)N1)C=CC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1[C@@H](C/C(=C\2/C=CC=CC2=O)/N1)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2/c1-2-20(24)22-16(13-12-15-8-4-3-5-9-15)14-18(21-22)17-10-6-7-11-19(17)23/h3-13,16,21H,2,14H2,1H3/b13-12+,18-17+/t16-/m1/s1