1-[(R)-(4-chlorophenyl)-phenyl-methyl]-4-(2,4-dinitrophenyl)piperazin-1-ium

Systemtic Name: 1-[(R)-(4-chlorophenyl)-phenyl-methyl]-4-(2,4-dinitrophenyl)piperazin-1-ium Openeye Name: 1-[(R)-(4-chlorophenyl)-phenyl-methyl]-4-(2,4-dinitrophenyl)piperazin-1-ium CAS Name: 1-[(R)-(4-chlorophenyl)-phenylmethyl]-4-(2,4-dinitrophenyl)piperazin-1-ium IUPAC Name: 1-[(R)-(4-chlorophenyl)-phenylmethyl]-4-(2,4-dinitrophenyl)piperazin-1-ium Traditional Name: 1-[(R)-(4-chlorophenyl)-phenyl-methyl]-4-(2,4-dinitrophenyl)piperazin-1-ium Formula: C23H22ClN4O4+ MolecularWeight: 453.89818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClN4O4/c24-19-8-6-18(7-9-19)23(17-4-2-1-3-5-17)26-14-12-25(13-15-26)21-11-10-20(27(29)30)16-22(21)28(31)32/h1-11,16,23H,12-15H2/p+1/t23-/m1/s1