(4-chlorophenyl)methyl-[(3S)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium

Systemtic Name: (4-chlorophenyl)methyl-[(3S)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium Openeye Name: (4-chlorophenyl)methyl-[(3S)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]ammonium CAS Name: (4-chlorophenyl)methyl-[(3S)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]ammonium IUPAC Name: (4-chlorophenyl)methyl-[(3S)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]azanium Traditional Name: (4-chlorobenzyl)-[(3S)-6-hydroxycoumaran-3-yl]ammonium Formula: C15H15ClNO2+ MolecularWeight: 276.7381

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(O1)C=C(C=C2)O)[NH2+]CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1[C@H](C2=C(O1)C=C(C=C2)O)[NH2+]CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H14ClNO2/c16-11-3-1-10(2-4-11)8-17-14-9-19-15-7-12(18)5-6-13(14)15/h1-7,14,17-18H,8-9H2/p+1/t14-/m1/s1