N-(4-acetamido-3-chloranyl-phenyl)-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]ethanamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-2-[4-(6-nitro-3-pyridyl)piperazin-1-yl]acetamide CAS Name: N-(4-acetamido-3-chlorophenyl)-2-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]acetamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-2-[4-(6-nitro-3-pyridyl)piperazino]acetamide Formula: C19H21ClN6O4 MolecularWeight: 432.86084

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H21ClN6O4/c1-13(27)22-17-4-2-14(10-16(17)20)23-19(28)12-24-6-8-25(9-7-24)15-3-5-18(21-11-15)26(29)30/h2-5,10-11H,6-9,12H2,1H3,(H,22,27)(H,23,28)