(1S,3S)-1-(aminomethyl)-6-bromanyl-3-phenyl-3,4-dihydro-1H-isochromen-5-ol hydrochloride

Systemtic Name: (1S,3S)-1-(aminomethyl)-6-bromanyl-3-phenyl-3,4-dihydro-1H-isochromen-5-ol hydrochloride Openeye Name: (1S,3S)-1-(aminomethyl)-6-bromo-3-phenyl-isochroman-5-ol hydrochloride CAS Name: (1S,3S)-1-(aminomethyl)-6-bromo-3-phenyl-3,4-dihydro-1H-2-benzopyran-5-ol hydrochloride IUPAC Name: (1S,3S)-1-(aminomethyl)-6-bromo-3-phenyl-3,4-dihydro-1H-isochromen-5-ol hydrochloride Traditional Name: (1S,3S)-1-(aminomethyl)-6-bromo-3-phenyl-isochroman-5-ol hydrochloride Formula: C16H17BrClNO2 MolecularWeight: 370.66868

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(C2=C1C(=C(C=C2)Br)O)CN)C3=CC=CC=C3.Cl

Isomeric SMILES

C1[C@H](O[C@@H](C2=C1C(=C(C=C2)Br)O)CN)C3=CC=CC=C3.Cl

InChI

InChI=1S/C16H16BrNO2.ClH/c17-13-7-6-11-12(16(13)19)8-14(20-15(11)9-18)10-4-2-1-3-5-10;/h1-7,14-15,19H,8-9,18H2;1H/t14-,15+;/m0./s1