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

Systemtic Name: 4-(dimethylamino)-N-[[2-(dimethylamino)pyridin-4-yl]methyl]-3-nitro-benzamide Openeye Name: 4-(dimethylamino)-N-[[2-(dimethylamino)-4-pyridyl]methyl]-3-nitro-benzamide CAS Name: 4-(dimethylamino)-N-[[2-(dimethylamino)-4-pyridinyl]methyl]-3-nitrobenzamide IUPAC Name: 4-(dimethylamino)-N-[[2-(dimethylamino)pyridin-4-yl]methyl]-3-nitrobenzamide Traditional Name: 4-(dimethylamino)-N-[[2-(dimethylamino)-4-pyridyl]methyl]-3-nitro-benzamide Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5O3/c1-20(2)14-6-5-13(10-15(14)22(24)25)17(23)19-11-12-7-8-18-16(9-12)21(3)4/h5-10H,11H2,1-4H3,(H,19,23)