2-[(3,4-dichlorophenyl)amino]-6-nitro-8-[(E)-2-pyridin-2-ylethenyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(3,4-dichlorophenyl)amino]-6-nitro-8-[(E)-2-pyridin-2-ylethenyl]-1H-quinazolin-4-one Openeye Name: 2-(3,4-dichloroanilino)-6-nitro-8-[(E)-2-(2-pyridyl)vinyl]-1H-quinazolin-4-one CAS Name: 2-(3,4-dichloroanilino)-6-nitro-8-[(E)-2-(2-pyridinyl)ethenyl]-1H-quinazolin-4-one IUPAC Name: 2-(3,4-dichloroanilino)-6-nitro-8-[(E)-2-pyridin-2-ylethenyl]-1H-quinazolin-4-one Traditional Name: 2-(3,4-dichloroanilino)-6-nitro-8-[(E)-2-(2-pyridyl)vinyl]-1H-quinazolin-4-one Formula: C21H13Cl2N5O3 MolecularWeight: 454.26562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C=CC2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=NC(=C1)/C=C/C2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H13Cl2N5O3/c22-17-7-6-14(10-18(17)23)25-21-26-19-12(4-5-13-3-1-2-8-24-13)9-15(28(30)31)11-16(19)20(29)27-21/h1-11H,(H2,25,26,27,29)/b5-4+