N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-pentadecyl-6-propan-2-yloxy-benzamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-pentadecyl-6-propan-2-yloxy-benzamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-isopropoxy-6-pentadecyl-benzamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-pentadecyl-6-propan-2-yloxybenzamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-pentadecyl-6-propan-2-yloxybenzamide Traditional Name: 2-isopropoxy-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-6-pentadecyl-benzamide Formula: C36H53N3O3 MolecularWeight: 575.82432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C(=CC=C1)OC(C)C)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C(=CC=C1)OC(C)C)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C36H53N3O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-19-23-30-24-22-27-32(42-28(2)3)33(30)35(40)37-34-29(4)38(5)39(36(34)41)31-25-20-18-21-26-31/h18,20-22,24-28H,6-17,19,23H2,1-5H3,(H,37,40)