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4-[4-[[(4-ethanoyl-2-nitro-phenyl)amino]methyl]phenyl]piperazin-2-one
4-[4-[[(4-ethanoyl-2-nitro-phenyl)amino]methyl]phenyl]piperazin-2-one
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)C1=CC(=C(C=C1)NCC2=CC=C(C=C2)N3CCNC(=O)C3)[N+](=O)[O-]
Isomeric SMILES
CC(=O)C1=CC(=C(C=C1)NCC2=CC=C(C=C2)N3CCNC(=O)C3)[N+](=O)[O-]
InChI
InChI=1S/C19H20N4O4/c1-13(24)15-4-7-17(18(10-15)23(26)27)21-11-14-2-5-16(6-3-14)22-9-8-20-19(25)12-22/h2-7,10,21H,8-9,11-12H2,1H3,(H,20,25)
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