N-[[2-(dimethylamino)pyridin-4-yl]methyl]-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-4-yl]methyl]-4-(methylamino)-3-nitro-benzamide Openeye Name: N-[[2-(dimethylamino)-4-pyridyl]methyl]-4-(methylamino)-3-nitro-benzamide CAS Name: N-[[2-(dimethylamino)-4-pyridinyl]methyl]-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-[[2-(dimethylamino)pyridin-4-yl]methyl]-4-(methylamino)-3-nitrobenzamide Traditional Name: N-[[2-(dimethylamino)-4-pyridyl]methyl]-4-(methylamino)-3-nitro-benzamide Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NCC2=CC(=NC=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NCC2=CC(=NC=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3/c1-17-13-5-4-12(9-14(13)21(23)24)16(22)19-10-11-6-7-18-15(8-11)20(2)3/h4-9,17H,10H2,1-3H3,(H,19,22)