4-bromanyl-6-[(5R)-5-pyridin-3-ylpyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[(5R)-5-pyridin-3-ylpyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[(5R)-5-(3-pyridyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[(5R)-5-(3-pyridinyl)-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[(5R)-5-pyridin-3-ylpyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[(5R)-5-(3-pyridyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C14H12BrN3O MolecularWeight: 318.16858

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NNC1=C2C=C(C=CC2=O)Br)C3=CN=CC=C3

Isomeric SMILES

C1[C@@H](NNC1=C2C=C(C=CC2=O)Br)C3=CN=CC=C3

InChI

InChI=1S/C14H12BrN3O/c15-10-3-4-14(19)11(6-10)13-7-12(17-18-13)9-2-1-5-16-8-9/h1-6,8,12,17-18H,7H2/t12-/m1/s1