[4-(diphenylmethyl)piperazin-4-ium-1-yl]-(2-nitrophenyl)methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(2-nitrophenyl)methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-nitrophenyl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(2-nitrophenyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-nitrophenyl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(2-nitrophenyl)methanone Formula: C24H24N3O3+ MolecularWeight: 402.46566

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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=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O3/c28-24(21-13-7-8-14-22(21)27(29)30)26-17-15-25(16-18-26)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-14,23H,15-18H2/p+1