6-chloranyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[[4-(4-nitrophenyl)piperazino]methyl]-1H-quinazolin-4-one Formula: C19H18ClN5O3 MolecularWeight: 399.83092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN5O3/c20-13-1-6-17-16(11-13)19(26)22-18(21-17)12-23-7-9-24(10-8-23)14-2-4-15(5-3-14)25(27)28/h1-6,11H,7-10,12H2,(H,21,22,26)