1,3-benzothiazol-2-ylmethyl-[(5-methoxy-2-oxidanyl-phenyl)methyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(5-methoxy-2-oxidanyl-phenyl)methyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(2-hydroxy-5-methoxy-phenyl)methyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(2-hydroxy-5-methoxyphenyl)methyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(2-hydroxy-5-methoxyphenyl)methyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-(2-hydroxy-5-methoxy-benzyl)ammonium Formula: C16H17N2O2S+ MolecularWeight: 301.38338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C[NH2+]CC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC(=C(C=C1)O)C[NH2+]CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H16N2O2S/c1-20-12-6-7-14(19)11(8-12)9-17-10-16-18-13-4-2-3-5-15(13)21-16/h2-8,17,19H,9-10H2,1H3/p+1