2-[propan-2-yl-[(3,4,5-trimethoxyphenyl)methyl]azaniumyl]ethanoate

Systemtic Name: 2-[propan-2-yl-[(3,4,5-trimethoxyphenyl)methyl]azaniumyl]ethanoate Openeye Name: 2-[isopropyl-[(3,4,5-trimethoxyphenyl)methyl]ammonio]acetate CAS Name: 2-[propan-2-yl-[(3,4,5-trimethoxyphenyl)methyl]ammonio]acetate IUPAC Name: 2-[propan-2-yl-[(3,4,5-trimethoxyphenyl)methyl]azaniumyl]acetate Traditional Name: 2-[isopropyl-(3,4,5-trimethoxybenzyl)ammonio]acetate Formula: C15H23NO5 MolecularWeight: 297.34682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC(=C(C(=C1)OC)OC)OC)CC(=O)[O-]

Isomeric SMILES

CC(C)[NH+](CC1=CC(=C(C(=C1)OC)OC)OC)CC(=O)[O-]

InChI

InChI=1S/C15H23NO5/c1-10(2)16(9-14(17)18)8-11-6-12(19-3)15(21-5)13(7-11)20-4/h6-7,10H,8-9H2,1-5H3,(H,17,18)