N-[[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylphenyl]methyl]ethanamide

Systemtic Name: N-[[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylphenyl]methyl]ethanamide Openeye Name: N-[[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]phenyl]methyl]acetamide CAS Name: N-[[4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]acetamide IUPAC Name: N-[[4-[4-(6-nitropyridin-3-yl)piperazine-1-carbonyl]phenyl]methyl]acetamide Traditional Name: N-[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]benzyl]acetamide Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O4/c1-14(25)20-12-15-2-4-16(5-3-15)19(26)23-10-8-22(9-11-23)17-6-7-18(21-13-17)24(27)28/h2-7,13H,8-12H2,1H3,(H,20,25)