[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-(5-nitrofuran-2-yl)methanone

Systemtic Name: [4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-(5-nitrofuran-2-yl)methanone Openeye Name: [4-[(5,6-dimethylbenzimidazol-1-yl)methyl]-1-piperidyl]-(5-nitro-2-furyl)methanone CAS Name: [4-[(5,6-dimethyl-1-benzimidazolyl)methyl]-1-piperidinyl]-(5-nitro-2-furanyl)methanone IUPAC Name: [4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-(5-nitrofuran-2-yl)methanone Traditional Name: [4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidino]-(5-nitro-2-furyl)methanone Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)CC3CCN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)CC3CCN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4/c1-13-9-16-17(10-14(13)2)23(12-21-16)11-15-5-7-22(8-6-15)20(25)18-3-4-19(28-18)24(26)27/h3-4,9-10,12,15H,5-8,11H2,1-2H3