7-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-6-nitro-1H-quinazolin-4-one Openeye Name: 7-[3-(1H-benzimidazol-2-yl)-1-piperidyl]-6-nitro-1H-quinazolin-4-one CAS Name: 7-[3-(1H-benzimidazol-2-yl)-1-piperidinyl]-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-6-nitro-1H-quinazolin-4-one Traditional Name: 7-[3-(1H-benzimidazol-2-yl)piperidino]-6-nitro-1H-quinazolin-4-one Formula: C20H18N6O3 MolecularWeight: 390.39532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-])C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-])C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C20H18N6O3/c27-20-13-8-18(26(28)29)17(9-16(13)21-11-22-20)25-7-3-4-12(10-25)19-23-14-5-1-2-6-15(14)24-19/h1-2,5-6,8-9,11-12H,3-4,7,10H2,(H,23,24)(H,21,22,27)