5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-[(pyridin-3-ylmethylamino)methylidene]pyrazol-3-one

Systemtic Name: 5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-[(pyridin-3-ylmethylamino)methylidene]pyrazol-3-one Openeye Name: 5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-[(3-pyridylmethylamino)methylene]pyrazol-3-one CAS Name: 5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-[(3-pyridinylmethylamino)methylidene]-3-pyrazolone IUPAC Name: 5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-[(pyridin-3-ylmethylamino)methylidene]pyrazol-3-one Traditional Name: 5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-[(3-pyridylmethylamino)methylene]-2-pyrazolin-3-one Formula: C23H19N5O4 MolecularWeight: 429.42806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C2=CNCC3=CN=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C2=CNCC3=CN=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O4/c1-32-20-10-4-17(5-11-20)22-21(15-25-14-16-3-2-12-24-13-16)23(29)27(26-22)18-6-8-19(9-7-18)28(30)31/h2-13,15,25H,14H2,1H3