N-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxy-2-nitro-phenyl]ethanamide hydrochloride

Systemtic Name: N-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxy-2-nitro-phenyl]ethanamide hydrochloride Openeye Name: N-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]-2-nitro-phenyl]acetamide hydrochloride CAS Name: N-[4-[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]oxy-2-nitrophenyl]acetamide hydrochloride IUPAC Name: N-[4-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]oxy-2-nitrophenyl]acetamide hydrochloride Traditional Name: N-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]-2-nitro-phenyl]acetamide hydrochloride Formula: C21H22Cl2N4O4 MolecularWeight: 465.32978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)OC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)[N+](=O)[O-].Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)OC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C21H21ClN4O4.ClH/c1-15(27)24-20-9-8-18(12-21(20)26(28)29)30-19(13-25-11-10-23-14-25)7-4-16-2-5-17(22)6-3-16;/h2-3,5-6,8-12,14,19H,4,7,13H2,1H3,(H,24,27);1H