N-[(E)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[(E)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[(E)-(2-chloro-5-nitro-phenyl)methyleneamino]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[(E)-(2-chloro-5-nitro-benzylidene)amino]-4-keto-1H-quinazoline-2-carboxamide Formula: C16H10ClN5O4 MolecularWeight: 371.7347

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClN5O4/c17-12-6-5-10(22(25)26)7-9(12)8-18-21-16(24)14-19-13-4-2-1-3-11(13)15(23)20-14/h1-8H,(H,21,24)(H,19,20,23)/b18-8+