4-[(3-ethoxy-4-phenylmethoxy-phenyl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 4-[(3-ethoxy-4-phenylmethoxy-phenyl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-[(4-benzyloxy-3-ethoxy-phenyl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one CAS Name: 4-[(3-ethoxy-4-phenylmethoxyphenyl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-[(3-ethoxy-4-phenylmethoxyphenyl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-(4-benzoxy-3-ethoxy-benzyl)-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC2=C(NN(C2=O)C3=CC=CC=C3)C)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC2=C(NN(C2=O)C3=CC=CC=C3)C)OCC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O3/c1-3-30-25-17-21(14-15-24(25)31-18-20-10-6-4-7-11-20)16-23-19(2)27-28(26(23)29)22-12-8-5-9-13-22/h4-15,17,27H,3,16,18H2,1-2H3