5-ethyl-2-[2-(4-phenylphenoxy)butyl]-1H-pyrazol-3-one

Systemtic Name: 5-ethyl-2-[2-(4-phenylphenoxy)butyl]-1H-pyrazol-3-one Openeye Name: 5-ethyl-2-[2-(4-phenylphenoxy)butyl]-1H-pyrazol-3-one CAS Name: 5-ethyl-2-[2-(4-phenylphenoxy)butyl]-1H-pyrazol-3-one IUPAC Name: 5-ethyl-2-[2-(4-phenylphenoxy)butyl]-1H-pyrazol-3-one Traditional Name: 5-ethyl-2-[2-(4-phenylphenoxy)butyl]-3-pyrazolin-3-one Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N(N1)CC(CC)OC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=O)N(N1)CC(CC)OC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2/c1-3-18-14-21(24)23(22-18)15-19(4-2)25-20-12-10-17(11-13-20)16-8-6-5-7-9-16/h5-14,19,22H,3-4,15H2,1-2H3