4-(indol-3-ylidenemethyl)-5-(4-methoxyphenyl)-2-(phenylmethyl)-1H-pyrazol-3-one

Systemtic Name: 4-(indol-3-ylidenemethyl)-5-(4-methoxyphenyl)-2-(phenylmethyl)-1H-pyrazol-3-one Openeye Name: 2-benzyl-4-(indol-3-ylidenemethyl)-5-(4-methoxyphenyl)-1H-pyrazol-3-one CAS Name: 4-(3-indolylidenemethyl)-5-(4-methoxyphenyl)-2-(phenylmethyl)-1H-pyrazol-3-one IUPAC Name: 2-benzyl-4-(indol-3-ylidenemethyl)-5-(4-methoxyphenyl)-1H-pyrazol-3-one Traditional Name: 2-benzyl-4-(indol-3-ylidenemethyl)-5-(4-methoxyphenyl)-3-pyrazolin-3-one Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N(N2)CC3=CC=CC=C3)C=C4C=NC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N(N2)CC3=CC=CC=C3)C=C4C=NC5=CC=CC=C54

InChI

InChI=1S/C26H21N3O2/c1-31-21-13-11-19(12-14-21)25-23(15-20-16-27-24-10-6-5-9-22(20)24)26(30)29(28-25)17-18-7-3-2-4-8-18/h2-16,28H,17H2,1H3