3-chloranyl-1-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-5-nitro-indazole

Systemtic Name: 3-chloranyl-1-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-5-nitro-indazole Openeye Name: 3-chloro-1-[(1-isopentylbenzimidazol-2-yl)methyl]-5-nitro-indazole CAS Name: 3-chloro-1-[[1-(3-methylbutyl)-2-benzimidazolyl]methyl]-5-nitroindazole IUPAC Name: 3-chloro-1-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-5-nitroindazole Traditional Name: 3-chloro-1-[(1-isoamylbenzimidazol-2-yl)methyl]-5-nitro-indazole Formula: C20H20ClN5O2 MolecularWeight: 397.8581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=C(C=C(C=C4)[N+](=O)[O-])C(=N3)Cl

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=C(C=C(C=C4)[N+](=O)[O-])C(=N3)Cl

InChI

InChI=1S/C20H20ClN5O2/c1-13(2)9-10-24-18-6-4-3-5-16(18)22-19(24)12-25-17-8-7-14(26(27)28)11-15(17)20(21)23-25/h3-8,11,13H,9-10,12H2,1-2H3