(3-ethoxy-4-phenylmethoxy-phenyl)methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (3-ethoxy-4-phenylmethoxy-phenyl)methyl-(thiophen-2-ylmethyl)azanium Openeye Name: (4-benzyloxy-3-ethoxy-phenyl)methyl-(2-thienylmethyl)ammonium CAS Name: (3-ethoxy-4-phenylmethoxyphenyl)methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (3-ethoxy-4-phenylmethoxyphenyl)methyl-(thiophen-2-ylmethyl)azanium Traditional Name: (4-benzoxy-3-ethoxy-benzyl)-(2-thenyl)ammonium Formula: C21H24NO2S+ MolecularWeight: 354.48576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC=CS2)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC=CS2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H23NO2S/c1-2-23-21-13-18(14-22-15-19-9-6-12-25-19)10-11-20(21)24-16-17-7-4-3-5-8-17/h3-13,22H,2,14-16H2,1H3/p+1