4-[(2,4-dinitrophenyl)methyl]-1-(phenylmethyl)quinolin-1-ium

Systemtic Name: 4-[(2,4-dinitrophenyl)methyl]-1-(phenylmethyl)quinolin-1-ium Openeye Name: 1-benzyl-4-[(2,4-dinitrophenyl)methyl]quinolin-1-ium CAS Name: 4-[(2,4-dinitrophenyl)methyl]-1-(phenylmethyl)quinolin-1-ium IUPAC Name: 1-benzyl-4-[(2,4-dinitrophenyl)methyl]quinolin-1-ium Traditional Name: 1-benzyl-4-(2,4-dinitrobenzyl)quinolin-1-ium Formula: C23H18N3O4+ MolecularWeight: 400.40672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=C(C3=CC=CC=C32)CC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=C(C3=CC=CC=C32)CC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H18N3O4/c27-25(28)20-11-10-19(23(15-20)26(29)30)14-18-12-13-24(16-17-6-2-1-3-7-17)22-9-5-4-8-21(18)22/h1-13,15H,14,16H2/q+1