8-nitro-2-[(E)-2-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]ethenyl]quinoline

Systemtic Name: 8-nitro-2-[(E)-2-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]ethenyl]quinoline Openeye Name: 2-[(E)-2-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]vinyl]-8-nitro-quinoline CAS Name: 8-nitro-2-[(E)-2-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]ethenyl]quinoline IUPAC Name: 2-[(E)-2-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)ethenyl]-8-nitroquinoline Traditional Name: 2-[(E)-2-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]vinyl]-8-nitro-quinoline Formula: C26H19N5O2 MolecularWeight: 433.46136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)C=CC4=NC5=C(C=CC=C5[N+](=O)[O-])C=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)/C=C/C4=NC5=C(C=CC=C5[N+](=O)[O-])C=C4

InChI

InChI=1S/C26H19N5O2/c32-31(33)24-10-4-8-20-11-13-23(28-26(20)24)14-12-22-18-30(17-19-6-2-1-3-7-19)29-25(22)21-9-5-15-27-16-21/h1-16,18H,17H2/b14-12+