N-(5-acetamido-2-methoxy-phenyl)-2-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-(4-chloro-2-nitro-phenyl)piperazino]acetamide Formula: C21H24ClN5O5 MolecularWeight: 461.89876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN5O5/c1-14(28)23-16-4-6-20(32-2)17(12-16)24-21(29)13-25-7-9-26(10-8-25)18-5-3-15(22)11-19(18)27(30)31/h3-6,11-12H,7-10,13H2,1-2H3,(H,23,28)(H,24,29)