[3-[4-acetyloxy-3-(3-methoxy-3-oxidanylidene-propyl)phenyl]-1-methoxy-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [3-[4-acetyloxy-3-(3-methoxy-3-oxidanylidene-propyl)phenyl]-1-methoxy-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [1-[[4-acetoxy-3-(3-methoxy-3-oxo-propyl)phenyl]methyl]-2-methoxy-2-oxo-ethyl]ammonium CAS Name: [3-[4-acetyloxy-3-(3-methoxy-3-oxopropyl)phenyl]-1-methoxy-1-oxopropan-2-yl]ammonium IUPAC Name: [3-[4-acetyloxy-3-(3-methoxy-3-oxopropyl)phenyl]-1-methoxy-1-oxopropan-2-yl]azanium Traditional Name: [1-[4-acetoxy-3-(3-keto-3-methoxy-propyl)benzyl]-2-keto-2-methoxy-ethyl]ammonium Formula: C16H22NO6+ MolecularWeight: 324.34898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)OC)[NH3+])CCC(=O)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)OC)[NH3+])CCC(=O)OC

InChI

InChI=1S/C16H21NO6/c1-10(18)23-14-6-4-11(9-13(17)16(20)22-3)8-12(14)5-7-15(19)21-2/h4,6,8,13H,5,7,9,17H2,1-3H3/p+1