1-[4-[4-[2-(4-chlorophenyl)ethylamino]-6-nitro-quinazolin-7-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-[2-(4-chlorophenyl)ethylamino]-6-nitro-quinazolin-7-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-[2-(4-chlorophenyl)ethylamino]-6-nitro-quinazolin-7-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[2-(4-chlorophenyl)ethylamino]-6-nitro-7-quinazolinyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-[2-(4-chlorophenyl)ethylamino]-6-nitroquinazolin-7-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-[2-(4-chlorophenyl)ethylamino]-6-nitro-quinazolin-7-yl]piperazino]ethanone Formula: C22H23ClN6O3 MolecularWeight: 454.90942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N=CN=C3NCCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N=CN=C3NCCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H23ClN6O3/c1-15(30)27-8-10-28(11-9-27)20-13-19-18(12-21(20)29(31)32)22(26-14-25-19)24-7-6-16-2-4-17(23)5-3-16/h2-5,12-14H,6-11H2,1H3,(H,24,25,26)