4-[(3S,4R)-4-(3-methylthiophen-2-yl)pyrrolidin-3-yl]benzene-1,2-diol hydrobromide

Systemtic Name: 4-[(3S,4R)-4-(3-methylthiophen-2-yl)pyrrolidin-3-yl]benzene-1,2-diol hydrobromide Openeye Name: 4-[(3S,4R)-4-(3-methyl-2-thienyl)pyrrolidin-3-yl]benzene-1,2-diol hydrobromide CAS Name: 4-[(3S,4R)-4-(3-methyl-2-thiophenyl)-3-pyrrolidinyl]benzene-1,2-diol hydrobromide IUPAC Name: 4-[(3S,4R)-4-(3-methylthiophen-2-yl)pyrrolidin-3-yl]benzene-1,2-diol hydrobromide Traditional Name: 4-[(3S,4R)-4-(3-methyl-2-thienyl)pyrrolidin-3-yl]pyrocatechol hydrobromide Formula: C15H18BrNO2S MolecularWeight: 356.27792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2CNCC2C3=CC(=C(C=C3)O)O.Br

Isomeric SMILES

CC1=C(SC=C1)[C@H]2CNC[C@@H]2C3=CC(=C(C=C3)O)O.Br

InChI

InChI=1S/C15H17NO2S.BrH/c1-9-4-5-19-15(9)12-8-16-7-11(12)10-2-3-13(17)14(18)6-10;/h2-6,11-12,16-18H,7-8H2,1H3;1H/t11-,12+;/m1./s1