(3-bromanyl-4-methoxy-phenyl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanamine

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanamine Openeye Name: (3-bromo-4-methoxy-phenyl)-(4,5,6,7-tetrahydrobenzothiophen-2-yl)methanamine CAS Name: (3-bromo-4-methoxyphenyl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanamine IUPAC Name: (3-bromo-4-methoxyphenyl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanamine Traditional Name: [(3-bromo-4-methoxy-phenyl)-(4,5,6,7-tetrahydrobenzothiophen-2-yl)methyl]amine Formula: C16H18BrNOS MolecularWeight: 352.28922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=CC3=C(S2)CCCC3)N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=CC3=C(S2)CCCC3)N)Br

InChI

InChI=1S/C16H18BrNOS/c1-19-13-7-6-11(8-12(13)17)16(18)15-9-10-4-2-3-5-14(10)20-15/h6-9,16H,2-5,18H2,1H3