trimethyl-[3-methyl-4-oxidanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butyl]azanium

Systemtic Name: trimethyl-[3-methyl-4-oxidanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butyl]azanium Openeye Name: [2-(benzyloxycarbonylamino)-4-hydroxy-3-methyl-4-oxo-butyl]-trimethyl-ammonium CAS Name: [4-hydroxy-3-methyl-4-oxo-2-(phenylmethoxycarbonylamino)butyl]-trimethylammonium IUPAC Name: [4-hydroxy-3-methyl-4-oxo-2-(phenylmethoxycarbonylamino)butyl]-trimethylazanium Traditional Name: [2-(benzyloxycarbonylamino)-4-hydroxy-4-keto-3-methyl-butyl]-trimethyl-ammonium Formula: C16H25N2O4+ MolecularWeight: 309.3807

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C[N+](C)(C)C)NC(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C(C[N+](C)(C)C)NC(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C16H24N2O4/c1-12(15(19)20)14(10-18(2,3)4)17-16(21)22-11-13-8-6-5-7-9-13/h5-9,12,14H,10-11H2,1-4H3,(H-,17,19,20,21)/p+1