2-methyl-5-nitro-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-methyl-5-nitro-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-[[4-(isopropoxymethyl)phenyl]methyl]-2-methyl-5-nitro-pyridine-3-carboxamide CAS Name: 2-methyl-5-nitro-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-methyl-5-nitro-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-[4-(isopropoxymethyl)benzyl]-2-methyl-5-nitro-nicotinamide Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C(=O)NCC2=CC=C(C=C2)COC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1C(=O)NCC2=CC=C(C=C2)COC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4/c1-12(2)25-11-15-6-4-14(5-7-15)9-20-18(22)17-8-16(21(23)24)10-19-13(17)3/h4-8,10,12H,9,11H2,1-3H3,(H,20,22)