[(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[3-(cyclopropylmethoxy)propyl]azanium

Systemtic Name: [(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[3-(cyclopropylmethoxy)propyl]azanium Openeye Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-[3-(cyclopropylmethoxy)propyl]ammonium CAS Name: [(1S)-1-(5-bromo-2-benzofuranyl)ethyl]-[3-(cyclopropylmethoxy)propyl]ammonium IUPAC Name: [(1S)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-[3-(cyclopropylmethoxy)propyl]azanium Traditional Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-[3-(cyclopropylmethoxy)propyl]ammonium Formula: C17H23BrNO2+ MolecularWeight: 353.27402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(O1)C=CC(=C2)Br)[NH2+]CCCOCC3CC3

Isomeric SMILES

C[C@@H](C1=CC2=C(O1)C=CC(=C2)Br)[NH2+]CCCOCC3CC3

InChI

InChI=1S/C17H22BrNO2/c1-12(19-7-2-8-20-11-13-3-4-13)17-10-14-9-15(18)5-6-16(14)21-17/h5-6,9-10,12-13,19H,2-4,7-8,11H2,1H3/p+1/t12-/m0/s1