(E)-2-(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-(6-chloro-4-oxo-1H-quinazolin-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-(6-chloro-4-oxo-1H-quinazolin-2-yl)-3-(3-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(6-chloro-4-oxo-1H-quinazolin-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(6-chloro-4-keto-1H-quinazolin-2-yl)-3-(3-nitrophenyl)acrylonitrile Formula: C17H9ClN4O3 MolecularWeight: 352.73136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=C(C#N)C2=NC(=O)C3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C(\C#N)/C2=NC(=O)C3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C17H9ClN4O3/c18-12-4-5-15-14(8-12)17(23)21-16(20-15)11(9-19)6-10-2-1-3-13(7-10)22(24)25/h1-8H,(H,20,21,23)/b11-6+