(1R,3S)-1-(aminomethyl)-3-ethyl-3,4-dihydro-1H-isochromene-5,6-diol hydrochloride

Systemtic Name: (1R,3S)-1-(aminomethyl)-3-ethyl-3,4-dihydro-1H-isochromene-5,6-diol hydrochloride Openeye Name: (1R,3S)-1-(aminomethyl)-3-ethyl-isochromane-5,6-diol hydrochloride CAS Name: (1R,3S)-1-(aminomethyl)-3-ethyl-3,4-dihydro-1H-2-benzopyran-5,6-diol hydrochloride IUPAC Name: (1R,3S)-1-(aminomethyl)-3-ethyl-3,4-dihydro-1H-isochromene-5,6-diol hydrochloride Traditional Name: (1R,3S)-1-(aminomethyl)-3-ethyl-isochroman-5,6-diol hydrochloride Formula: C12H18ClNO3 MolecularWeight: 259.72922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2=C(C=CC(=C2O)O)C(O1)CN.Cl

Isomeric SMILES

CC[C@H]1CC2=C(C=CC(=C2O)O)[C@@H](O1)CN.Cl

InChI

InChI=1S/C12H17NO3.ClH/c1-2-7-5-9-8(11(6-13)16-7)3-4-10(14)12(9)15;/h3-4,7,11,14-15H,2,5-6,13H2,1H3;1H/t7-,11-;/m0./s1