(E)-3-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-[5-(2-chloro-4-nitrophenyl)-2-furanyl]-2-(4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-2-(4-keto-1H-quinazolin-2-yl)acrylonitrile Formula: C21H11ClN4O4 MolecularWeight: 418.78944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)/C(=C/C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)/C#N

InChI

InChI=1S/C21H11ClN4O4/c22-17-10-13(26(28)29)5-7-15(17)19-8-6-14(30-19)9-12(11-23)20-24-18-4-2-1-3-16(18)21(27)25-20/h1-10H,(H,24,25,27)/b12-9+