(1Z)-1-(3-nitro-6-phenyl-1-pyridin-4-yl-3H-pyridin-1-ium-4-ylidene)-3-pyridin-3-yl-urea

Systemtic Name: (1Z)-1-(3-nitro-6-phenyl-1-pyridin-4-yl-3H-pyridin-1-ium-4-ylidene)-3-pyridin-3-yl-urea Openeye Name: (1Z)-1-[3-nitro-6-phenyl-1-(4-pyridyl)-3H-pyridin-1-ium-4-ylidene]-3-(3-pyridyl)urea CAS Name: (1Z)-1-(3-nitro-6-phenyl-1-pyridin-4-yl-3H-pyridin-1-ium-4-ylidene)-3-(3-pyridinyl)urea IUPAC Name: (1Z)-1-(3-nitro-6-phenyl-1-pyridin-4-yl-3H-pyridin-1-ium-4-ylidene)-3-pyridin-3-ylurea Traditional Name: (1Z)-1-[3-nitro-6-phenyl-1-(4-pyridyl)-3H-pyridin-1-ium-4-ylidene]-3-(3-pyridyl)urea Formula: C22H17N6O3+ MolecularWeight: 413.40878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=O)NC3=CN=CC=C3)C(C=[N+]2C4=CC=NC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C/C(=N/C(=O)NC3=CN=CC=C3)/C(C=[N+]2C4=CC=NC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N6O3/c29-22(25-17-7-4-10-24-14-17)26-19-13-20(16-5-2-1-3-6-16)27(15-21(19)28(30)31)18-8-11-23-12-9-18/h1-15,21H/p+1/b26-19-