2,1,3-benzoxadiazol-5-yl-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: 2,1,3-benzoxadiazol-5-yl-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2,1,3-benzoxadiazol-5-yl)methanone CAS Name: 2,1,3-benzoxadiazol-5-yl-[4-(diphenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2,1,3-benzoxadiazol-5-yl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-benzofurazan-5-yl-methanone Formula: C24H23N4O2+ MolecularWeight: 399.46502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC5=NON=C5C=C4

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC5=NON=C5C=C4

InChI

InChI=1S/C24H22N4O2/c29-24(20-11-12-21-22(17-20)26-30-25-21)28-15-13-27(14-16-28)23(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-12,17,23H,13-16H2/p+1