1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-6-nitro-indazole

Systemtic Name: 1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-6-nitro-indazole Openeye Name: 1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-6-nitro-indazole CAS Name: 1-[[4-(3-chlorophenyl)-1-piperazin-1-iumyl]methyl]-6-nitroindazole IUPAC Name: 1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-6-nitroindazole Traditional Name: 1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-6-nitro-indazole Formula: C18H19ClN5O2+ MolecularWeight: 372.82876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H18ClN5O2/c19-15-2-1-3-16(10-15)22-8-6-21(7-9-22)13-23-18-11-17(24(25)26)5-4-14(18)12-20-23/h1-5,10-12H,6-9,13H2/p+1