4-[5-[4-(2-chloranylquinazolin-4-yl)piperazin-1-yl]-2-nitro-phenyl]morpholine

Systemtic Name: 4-[5-[4-(2-chloranylquinazolin-4-yl)piperazin-1-yl]-2-nitro-phenyl]morpholine Openeye Name: 4-[5-[4-(2-chloroquinazolin-4-yl)piperazin-1-yl]-2-nitro-phenyl]morpholine CAS Name: 4-[5-[4-(2-chloro-4-quinazolinyl)-1-piperazinyl]-2-nitrophenyl]morpholine IUPAC Name: 4-[5-[4-(2-chloroquinazolin-4-yl)piperazin-1-yl]-2-nitrophenyl]morpholine Traditional Name: 4-[5-[4-(2-chloroquinazolin-4-yl)piperazino]-2-nitro-phenyl]morpholine Formula: C22H23ClN6O3 MolecularWeight: 454.90942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)C4=NC(=NC5=CC=CC=C54)Cl

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)C4=NC(=NC5=CC=CC=C54)Cl

InChI

InChI=1S/C22H23ClN6O3/c23-22-24-18-4-2-1-3-17(18)21(25-22)28-9-7-26(8-10-28)16-5-6-19(29(30)31)20(15-16)27-11-13-32-14-12-27/h1-6,15H,7-14H2