4-(3-methyl-5-nitro-imidazol-4-yl)-N-(phenylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-(3-methyl-5-nitro-imidazol-4-yl)-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-benzyl-4-(3-methyl-5-nitro-imidazol-4-yl)piperazine-1-carboxamide CAS Name: 4-(3-methyl-5-nitro-4-imidazolyl)-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-benzyl-4-(3-methyl-5-nitroimidazol-4-yl)piperazine-1-carboxamide Traditional Name: N-benzyl-4-(3-methyl-5-nitro-imidazol-4-yl)piperazine-1-carboxamide Formula: C16H20N6O3 MolecularWeight: 344.3684

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N2CCN(CC2)C(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N2CCN(CC2)C(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H20N6O3/c1-19-12-18-14(22(24)25)15(19)20-7-9-21(10-8-20)16(23)17-11-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H,17,23)