(2R)-N-(4-methyl-2-nitro-phenyl)-2-(4-morpholin-4-ylcarbonylpiperazin-1-ium-1-yl)-2-phenyl-ethanamide

Systemtic Name: (2R)-N-(4-methyl-2-nitro-phenyl)-2-(4-morpholin-4-ylcarbonylpiperazin-1-ium-1-yl)-2-phenyl-ethanamide Openeye Name: (2R)-N-(4-methyl-2-nitro-phenyl)-2-[4-(morpholine-4-carbonyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-N-(4-methyl-2-nitrophenyl)-2-[4-[4-morpholinyl(oxo)methyl]-1-piperazin-1-iumyl]-2-phenylacetamide IUPAC Name: (2R)-N-(4-methyl-2-nitrophenyl)-2-[4-(morpholine-4-carbonyl)piperazin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2R)-N-(4-methyl-2-nitro-phenyl)-2-[4-(morpholine-4-carbonyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide Formula: C24H30N5O5+ MolecularWeight: 468.5255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@@H](C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H29N5O5/c1-18-7-8-20(21(17-18)29(32)33)25-23(30)22(19-5-3-2-4-6-19)26-9-11-27(12-10-26)24(31)28-13-15-34-16-14-28/h2-8,17,22H,9-16H2,1H3,(H,25,30)/p+1/t22-/m1/s1