N-(3-chloranyl-2,6-diethyl-phenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]acetamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-2-[4-(2-nitrophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]acetamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-2-[4-(2-nitrophenyl)piperazino]acetamide Formula: C22H27ClN4O3 MolecularWeight: 430.92778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H27ClN4O3/c1-3-16-9-10-18(23)17(4-2)22(16)24-21(28)15-25-11-13-26(14-12-25)19-7-5-6-8-20(19)27(29)30/h5-10H,3-4,11-15H2,1-2H3,(H,24,28)