methyl-[(5-methylfuran-2-yl)methyl]-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: methyl-[(5-methylfuran-2-yl)methyl]-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: methyl-[(5-methyl-2-furyl)methyl]-[(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: methyl-[(5-methyl-2-furanyl)methyl]-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: methyl-[(5-methylfuran-2-yl)methyl]-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(2-nitroanilino)ethyl]-methyl-[(5-methyl-2-furyl)methyl]ammonium Formula: C16H20N3O4+ MolecularWeight: 318.3477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+](C)C(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)C[NH+](C)[C@H](C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4/c1-11-8-9-13(23-11)10-18(3)12(2)16(20)17-14-6-4-5-7-15(14)19(21)22/h4-9,12H,10H2,1-3H3,(H,17,20)/p+1/t12-/m1/s1