(5E)-4-octyl-5-(1-oxidanylidenenaphthalen-2-ylidene)pyrazolidin-3-one

Systemtic Name: (5E)-4-octyl-5-(1-oxidanylidenenaphthalen-2-ylidene)pyrazolidin-3-one Openeye Name: (5E)-4-octyl-5-(1-oxo-2-naphthylidene)pyrazolidin-3-one CAS Name: (5E)-4-octyl-5-(1-oxo-2-naphthalenylidene)-3-pyrazolidinone IUPAC Name: (5E)-4-octyl-5-(1-oxonaphthalen-2-ylidene)pyrazolidin-3-one Traditional Name: (5E)-5-(1-keto-2-naphthylidene)-4-octyl-pyrazolidin-3-one Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(=C2C=CC3=CC=CC=C3C2=O)NNC1=O

Isomeric SMILES

CCCCCCCCC1/C(=C\2/C=CC3=CC=CC=C3C2=O)/NNC1=O

InChI

InChI=1S/C21H26N2O2/c1-2-3-4-5-6-7-12-18-19(22-23-21(18)25)17-14-13-15-10-8-9-11-16(15)20(17)24/h8-11,13-14,18,22H,2-7,12H2,1H3,(H,23,25)/b19-17+