2-[[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylidene]indene-1,3-dione

Systemtic Name: 2-[[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylidene]indene-1,3-dione Openeye Name: 2-[[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methylene]indane-1,3-dione CAS Name: 2-[[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]methylidene]indene-1,3-dione IUPAC Name: 2-[(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methylidene]indene-1,3-dione Traditional Name: 2-[[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methylene]indane-1,3-quinone Formula: C25H17N3O2 MolecularWeight: 391.42138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)C=C4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)C=C4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H17N3O2/c29-24-20-10-4-5-11-21(20)25(30)22(24)13-19-16-28(15-17-7-2-1-3-8-17)27-23(19)18-9-6-12-26-14-18/h1-14,16H,15H2