[(2S)-1-[[2,5-bis(methoxycarbonyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[[2,5-bis(methoxycarbonyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[[2,5-bis(methoxycarbonyl)phenyl]carbamoyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-[2,5-bis(methoxycarbonyl)anilino]-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-[2,5-bis(methoxycarbonyl)anilino]-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(2,5-dicarbomethoxyphenyl)carbamoyl]-2-methyl-propyl]ammonium Formula: C15H21N2O5+ MolecularWeight: 309.33764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC)[NH3+]

InChI

InChI=1S/C15H20N2O5/c1-8(2)12(16)13(18)17-11-7-9(14(19)21-3)5-6-10(11)15(20)22-4/h5-8,12H,16H2,1-4H3,(H,17,18)/p+1/t12-/m0/s1