1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxy-ethyl]-3-[(2-nitrophenyl)methyl]imidazol-3-ium

Systemtic Name: 1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxy-ethyl]-3-[(2-nitrophenyl)methyl]imidazol-3-ium Openeye Name: 1-[2-allyloxy-2-(2,4-dichlorophenyl)ethyl]-3-[(2-nitrophenyl)methyl]imidazol-3-ium CAS Name: 1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]-3-[(2-nitrophenyl)methyl]imidazol-3-ium IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]-3-[(2-nitrophenyl)methyl]imidazol-3-ium Traditional Name: 1-[2-allyloxy-2-(2,4-dichlorophenyl)ethyl]-3-(2-nitrobenzyl)imidazol-3-ium Formula: C21H20Cl2N3O3+ MolecularWeight: 433.3078

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(CN1C=C[N+](=C1)CC2=CC=CC=C2[N+](=O)[O-])C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C=CCOC(CN1C=C[N+](=C1)CC2=CC=CC=C2[N+](=O)[O-])C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H20Cl2N3O3/c1-2-11-29-21(18-8-7-17(22)12-19(18)23)14-25-10-9-24(15-25)13-16-5-3-4-6-20(16)26(27)28/h2-10,12,15,21H,1,11,13-14H2/q+1