(2R)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-(2-methoxy-4-nitro-phenyl)propanamide

Systemtic Name: (2R)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-(2-methoxy-4-nitro-phenyl)propanamide Openeye Name: (2R)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-methoxy-4-nitro-phenyl)propanamide CAS Name: (2R)-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(2-methoxy-4-nitrophenyl)propanamide IUPAC Name: (2R)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-methoxy-4-nitrophenyl)propanamide Traditional Name: (2R)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]-N-(2-methoxy-4-nitro-phenyl)propionamide Formula: C19H23N4O6+ MolecularWeight: 403.40912

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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)C3=CC=CO3

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC)[NH+]2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C19H22N4O6/c1-13(18(24)20-15-6-5-14(23(26)27)12-17(15)28-2)21-7-9-22(10-8-21)19(25)16-4-3-11-29-16/h3-6,11-13H,7-10H2,1-2H3,(H,20,24)/p+1/t13-/m1/s1