4-(methylamino)-3-nitro-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]benzamide

Systemtic Name: 4-(methylamino)-3-nitro-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]benzamide Openeye Name: 4-(methylamino)-3-nitro-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]benzamide CAS Name: 4-(methylamino)-3-nitro-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]benzamide IUPAC Name: 4-(methylamino)-3-nitro-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]benzamide Traditional Name: 4-(methylamino)-3-nitro-N-[(6-pyrrolidino-3-pyridyl)methyl]benzamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NCC2=CN=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NCC2=CN=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O3/c1-19-15-6-5-14(10-16(15)23(25)26)18(24)21-12-13-4-7-17(20-11-13)22-8-2-3-9-22/h4-7,10-11,19H,2-3,8-9,12H2,1H3,(H,21,24)