1-(dimethylamino)propan-2-yl 4-[2-(1-ethenyl-5-nitro-imidazol-2-yl)ethenyl]benzoate hydrochloride

Systemtic Name: 1-(dimethylamino)propan-2-yl 4-[2-(1-ethenyl-5-nitro-imidazol-2-yl)ethenyl]benzoate hydrochloride Openeye Name: [2-(dimethylamino)-1-methyl-ethyl] 4-[2-(5-nitro-1-vinyl-imidazol-2-yl)vinyl]benzoate hydrochloride CAS Name: 4-[2-(1-ethenyl-5-nitro-2-imidazolyl)ethenyl]benzoic acid 1-(dimethylamino)propan-2-yl ester hydrochloride IUPAC Name: 1-(dimethylamino)propan-2-yl 4-[2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzoate hydrochloride Traditional Name: 4-[2-(5-nitro-1-vinyl-imidazol-2-yl)vinyl]benzoic acid [2-(dimethylamino)-1-methyl-ethyl] ester hydrochloride Formula: C19H23ClN4O4 MolecularWeight: 406.86332

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)C)OC(=O)C1=CC=C(C=C1)C=CC2=NC=C(N2C=C)[N+](=O)[O-].Cl

Isomeric SMILES

CC(CN(C)C)OC(=O)C1=CC=C(C=C1)C=CC2=NC=C(N2C=C)[N+](=O)[O-].Cl

InChI

InChI=1S/C19H22N4O4.ClH/c1-5-22-17(20-12-18(22)23(25)26)11-8-15-6-9-16(10-7-15)19(24)27-14(2)13-21(3)4;/h5-12,14H,1,13H2,2-4H3;1H