3-(2-hydroxyethyl)-5-thiophen-3-yl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrochloride

Systemtic Name: 3-(2-hydroxyethyl)-5-thiophen-3-yl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrochloride Openeye Name: 3-(2-hydroxyethyl)-5-(3-thienyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrochloride CAS Name: 3-(2-hydroxyethyl)-5-(3-thiophenyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrochloride IUPAC Name: 3-(2-hydroxyethyl)-5-thiophen-3-yl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrochloride Traditional Name: 3-(2-hydroxyethyl)-5-(3-thienyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrochloride Formula: C16H20ClNO3S MolecularWeight: 341.8529

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C2=CC(=C(C=C21)O)O)C3=CSC=C3)CCO.Cl

Isomeric SMILES

C1CN(CC(C2=CC(=C(C=C21)O)O)C3=CSC=C3)CCO.Cl

InChI

InChI=1S/C16H19NO3S.ClH/c18-5-4-17-3-1-11-7-15(19)16(20)8-13(11)14(9-17)12-2-6-21-10-12;/h2,6-8,10,14,18-20H,1,3-5,9H2;1H