3-azanylidene-2-(3-pyridin-1-ium-1-ylquinoxalin-2-yl)prop-2-enenitrile

Systemtic Name: 3-azanylidene-2-(3-pyridin-1-ium-1-ylquinoxalin-2-yl)prop-2-enenitrile Openeye Name: 3-imino-2-(3-pyridin-1-ium-1-ylquinoxalin-2-yl)prop-2-enenitrile CAS Name: 3-imino-2-[3-(1-pyridin-1-iumyl)-2-quinoxalinyl]-2-propenenitrile IUPAC Name: 3-imino-2-(3-pyridin-1-ium-1-ylquinoxalin-2-yl)prop-2-enenitrile Traditional Name: 3-imino-2-(3-pyridin-1-ium-1-ylquinoxalin-2-yl)acrylonitrile Formula: C16H10N5+ MolecularWeight: 272.2841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C2=NC3=CC=CC=C3N=C2C(=C=N)C#N

Isomeric SMILES

C1=CC=[N+](C=C1)C2=NC3=CC=CC=C3N=C2C(=C=N)C#N

InChI

InChI=1S/C16H10N5/c17-10-12(11-18)15-16(21-8-4-1-5-9-21)20-14-7-3-2-6-13(14)19-15/h1-9,17H/q+1