7-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole

Systemtic Name: 7-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole Openeye Name: 7-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole CAS Name: 7-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-4-nitro-2,1,3-benzoxadiazole IUPAC Name: 7-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole Traditional Name: 4-[4-(5-chloro-2-methyl-phenyl)piperazino]-7-nitro-benzofurazan Formula: C17H16ClN5O3 MolecularWeight: 373.79364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN5O3/c1-11-2-3-12(18)10-15(11)22-8-6-21(7-9-22)13-4-5-14(23(24)25)17-16(13)19-26-20-17/h2-5,10H,6-9H2,1H3