(3-methoxy-4-phenethyloxy-phenyl)methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (3-methoxy-4-phenethyloxy-phenyl)methyl-(thiophen-2-ylmethyl)azanium Openeye Name: (3-methoxy-4-phenethyloxy-phenyl)methyl-(2-thienylmethyl)ammonium CAS Name: (3-methoxy-4-phenethyloxyphenyl)methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (3-methoxy-4-phenethyloxyphenyl)methyl-(thiophen-2-ylmethyl)azanium Traditional Name: (3-methoxy-4-phenethyloxy-benzyl)-(2-thenyl)ammonium Formula: C21H24NO2S+ MolecularWeight: 354.48576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CS2)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CS2)OCCC3=CC=CC=C3

InChI

InChI=1S/C21H23NO2S/c1-23-21-14-18(15-22-16-19-8-5-13-25-19)9-10-20(21)24-12-11-17-6-3-2-4-7-17/h2-10,13-14,22H,11-12,15-16H2,1H3/p+1