[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-phenethyl-azanium

Systemtic Name: [(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-phenethyl-azanium Openeye Name: [(1S)-isochroman-1-yl]methyl-phenethyl-ammonium CAS Name: [(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl-phenethylammonium IUPAC Name: [(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-phenethylazanium Traditional Name: [(1S)-isochroman-1-yl]methyl-phenethyl-ammonium Formula: C18H22NO+ MolecularWeight: 268.37338

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=CC=CC=C21)C[NH2+]CCC3=CC=CC=C3

Isomeric SMILES

C1CO[C@@H](C2=CC=CC=C21)C[NH2+]CCC3=CC=CC=C3

InChI

InChI=1S/C18H21NO/c1-2-6-15(7-3-1)10-12-19-14-18-17-9-5-4-8-16(17)11-13-20-18/h1-9,18-19H,10-14H2/p+1/t18-/m1/s1