1,3-benzodioxol-5-ylmethyl-[[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[[4-[(2-methylthiazol-4-yl)methoxy]phenyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[4-[(2-methyl-4-thiazolyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]methyl]azanium Traditional Name: [4-[(2-methylthiazol-4-yl)methoxy]benzyl]-piperonyl-ammonium Formula: C20H21N2O3S+ MolecularWeight: 369.45734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=C(C=C2)C[NH2+]CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=C(C=C2)C[NH2+]CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N2O3S/c1-14-22-17(12-26-14)11-23-18-5-2-15(3-6-18)9-21-10-16-4-7-19-20(8-16)25-13-24-19/h2-8,12,21H,9-11,13H2,1H3/p+1