2-[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-nitro-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]iminomethyl]-2-nitro-phenoxy]ethanenitrile Openeye Name: 2-[4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-nitro-phenoxy]acetonitrile CAS Name: 2-[4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-nitrophenoxy]acetonitrile IUPAC Name: 2-[4-[(2,4-dioxo-1H-quinazolin-3-yl)iminomethyl]-2-nitrophenoxy]acetonitrile Traditional Name: 2-[4-[(2,4-diketo-1H-quinazolin-3-yl)iminomethyl]-2-nitro-phenoxy]acetonitrile Formula: C17H11N5O5 MolecularWeight: 365.29974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N=CC3=CC(=C(C=C3)OCC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N=CC3=CC(=C(C=C3)OCC#N)[N+](=O)[O-]

InChI

InChI=1S/C17H11N5O5/c18-7-8-27-15-6-5-11(9-14(15)22(25)26)10-19-21-16(23)12-3-1-2-4-13(12)20-17(21)24/h1-6,9-10H,8H2,(H,20,24)