[1,4-bis(2-methylpropoxy)-1,4-bis(oxidanylidene)-3-phenyl-butan-2-yl]azanium

Systemtic Name: [1,4-bis(2-methylpropoxy)-1,4-bis(oxidanylidene)-3-phenyl-butan-2-yl]azanium Openeye Name: (3-isobutoxy-1-isobutoxycarbonyl-3-oxo-2-phenyl-propyl)ammonium CAS Name: [1,4-bis(2-methylpropoxy)-1,4-dioxo-3-phenylbutan-2-yl]ammonium IUPAC Name: [1,4-bis(2-methylpropoxy)-1,4-dioxo-3-phenylbutan-2-yl]azanium Traditional Name: (3-isobutoxy-1-isobutoxycarbonyl-3-keto-2-phenyl-propyl)ammonium Formula: C18H28NO4+ MolecularWeight: 322.41922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C1=CC=CC=C1)C(C(=O)OCC(C)C)[NH3+]

Isomeric SMILES

CC(C)COC(=O)C(C1=CC=CC=C1)C(C(=O)OCC(C)C)[NH3+]

InChI

InChI=1S/C18H27NO4/c1-12(2)10-22-17(20)15(14-8-6-5-7-9-14)16(19)18(21)23-11-13(3)4/h5-9,12-13,15-16H,10-11,19H2,1-4H3/p+1