9-chloranyl-3-methyl-5-(3-methylphenyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide

Systemtic Name: 9-chloranyl-3-methyl-5-(3-methylphenyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide Openeye Name: 9-chloro-3-methyl-5-(m-tolyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide CAS Name: 9-chloro-3-methyl-5-(3-methylphenyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide IUPAC Name: 9-chloro-3-methyl-5-(3-methylphenyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide Traditional Name: 9-chloro-3-methyl-5-(m-tolyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide Formula: C18H21BrClNO2 MolecularWeight: 398.72184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CN(CCC3=C(C(=C(C=C23)O)O)Cl)C.Br

Isomeric SMILES

CC1=CC=CC(=C1)C2CN(CCC3=C(C(=C(C=C23)O)O)Cl)C.Br

InChI

InChI=1S/C18H20ClNO2.BrH/c1-11-4-3-5-12(8-11)15-10-20(2)7-6-13-14(15)9-16(21)18(22)17(13)19;/h3-5,8-9,15,21-22H,6-7,10H2,1-2H3;1H