(2R)-N-(4-methoxy-2-nitro-phenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: (2R)-N-(4-methoxy-2-nitro-phenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: (2R)-N-(4-methoxy-2-nitro-phenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: (2R)-N-(4-methoxy-2-nitrophenyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: (2R)-N-(4-methoxy-2-nitrophenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: (2R)-N-(4-methoxy-2-nitro-phenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C15H24N4O4+2 MolecularWeight: 324.37546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N4O4/c1-11(18-8-6-17(2)7-9-18)15(20)16-13-5-4-12(23-3)10-14(13)19(21)22/h4-5,10-11H,6-9H2,1-3H3,(H,16,20)/p+2/t11-/m1/s1