(2R)-2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(2-methoxy-4-nitro-phenyl)propanamide

Systemtic Name: (2R)-2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(2-methoxy-4-nitro-phenyl)propanamide Openeye Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(2-methoxy-4-nitro-phenyl)propanamide CAS Name: (2R)-2-(4-acetyl-1-piperazin-1-iumyl)-N-(2-methoxy-4-nitrophenyl)propanamide IUPAC Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(2-methoxy-4-nitrophenyl)propanamide Traditional Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(2-methoxy-4-nitro-phenyl)propionamide Formula: C16H23N4O5+ MolecularWeight: 351.37762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC)[NH+]2CCN(CC2)C(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC)[NH+]2CCN(CC2)C(=O)C

InChI

InChI=1S/C16H22N4O5/c1-11(18-6-8-19(9-7-18)12(2)21)16(22)17-14-5-4-13(20(23)24)10-15(14)25-3/h4-5,10-11H,6-9H2,1-3H3,(H,17,22)/p+1/t11-/m1/s1