4-(4-methylpiperazin-1-yl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-(4-methylpiperazin-1-yl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-(4-methylpiperazin-1-yl)-3-nitro-N-(3-pyridylmethyl)benzamide CAS Name: 4-(4-methyl-1-piperazinyl)-3-nitro-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-(4-methylpiperazin-1-yl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-(4-methylpiperazino)-3-nitro-N-(3-pyridylmethyl)benzamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O3/c1-21-7-9-22(10-8-21)16-5-4-15(11-17(16)23(25)26)18(24)20-13-14-3-2-6-19-12-14/h2-6,11-12H,7-10,13H2,1H3,(H,20,24)