[(S)-[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]-phenyl-methyl]azanium

Systemtic Name: [(S)-[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]-phenyl-methyl]azanium Openeye Name: [(S)-[(2R)-2-methyl-2,3-dihydrobenzofuran-5-yl]-phenyl-methyl]ammonium CAS Name: [(S)-[(2R)-2-methyl-2,3-dihydrobenzofuran-5-yl]-phenylmethyl]ammonium IUPAC Name: [(S)-[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]-phenylmethyl]azanium Traditional Name: [(S)-[(2R)-2-methylcoumaran-5-yl]-phenyl-methyl]ammonium Formula: C16H18NO+ MolecularWeight: 240.32022

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C(C3=CC=CC=C3)[NH3+]

Isomeric SMILES

C[C@@H]1CC2=C(O1)C=CC(=C2)[C@H](C3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C16H17NO/c1-11-9-14-10-13(7-8-15(14)18-11)16(17)12-5-3-2-4-6-12/h2-8,10-11,16H,9,17H2,1H3/p+1/t11-,16+/m1/s1