2-[(3,4-dichlorophenyl)amino]-8-(1,3-dioxolan-2-yl)-6-nitro-1H-quinazolin-4-one

Systemtic Name: 2-[(3,4-dichlorophenyl)amino]-8-(1,3-dioxolan-2-yl)-6-nitro-1H-quinazolin-4-one Openeye Name: 2-(3,4-dichloroanilino)-8-(1,3-dioxolan-2-yl)-6-nitro-1H-quinazolin-4-one CAS Name: 2-(3,4-dichloroanilino)-8-(1,3-dioxolan-2-yl)-6-nitro-1H-quinazolin-4-one IUPAC Name: 2-(3,4-dichloroanilino)-8-(1,3-dioxolan-2-yl)-6-nitro-1H-quinazolin-4-one Traditional Name: 2-(3,4-dichloroanilino)-8-(1,3-dioxolan-2-yl)-6-nitro-1H-quinazolin-4-one Formula: C17H12Cl2N4O5 MolecularWeight: 423.20698

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)C2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1COC(O1)C2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C17H12Cl2N4O5/c18-12-2-1-8(5-13(12)19)20-17-21-14-10(15(24)22-17)6-9(23(25)26)7-11(14)16-27-3-4-28-16/h1-2,5-7,16H,3-4H2,(H2,20,21,22,24)