3-[(3,5-diphenylpyrazol-1-yl)methyl]-4-(2-methylpropoxy)benzaldehyde

Systemtic Name: 3-[(3,5-diphenylpyrazol-1-yl)methyl]-4-(2-methylpropoxy)benzaldehyde Openeye Name: 3-[(3,5-diphenylpyrazol-1-yl)methyl]-4-isobutoxy-benzaldehyde CAS Name: 3-[(3,5-diphenyl-1-pyrazolyl)methyl]-4-(2-methylpropoxy)benzaldehyde IUPAC Name: 3-[(3,5-diphenylpyrazol-1-yl)methyl]-4-(2-methylpropoxy)benzaldehyde Traditional Name: 3-[(3,5-diphenylpyrazol-1-yl)methyl]-4-isobutoxy-benzaldehyde Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C=O)CN2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C=O)CN2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O2/c1-20(2)19-31-27-14-13-21(18-30)15-24(27)17-29-26(23-11-7-4-8-12-23)16-25(28-29)22-9-5-3-6-10-22/h3-16,18,20H,17,19H2,1-2H3