3-methyl-N-[4-[(5-nitropyridin-2-yl)amino]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[(5-nitropyridin-2-yl)amino]phenyl]butanamide Openeye Name: 3-methyl-N-[4-[(5-nitro-2-pyridyl)amino]phenyl]butanamide CAS Name: 3-methyl-N-[4-[(5-nitro-2-pyridinyl)amino]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[(5-nitropyridin-2-yl)amino]phenyl]butanamide Traditional Name: 3-methyl-N-[4-[(5-nitro-2-pyridyl)amino]phenyl]butyramide Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O3/c1-11(2)9-16(21)19-13-5-3-12(4-6-13)18-15-8-7-14(10-17-15)20(22)23/h3-8,10-11H,9H2,1-2H3,(H,17,18)(H,19,21)