5-(4-hydroxyphenyl)-6-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide

Systemtic Name: 5-(4-hydroxyphenyl)-6-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide Openeye Name: 5-(4-hydroxyphenyl)-6-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide CAS Name: 5-(4-hydroxyphenyl)-6-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide IUPAC Name: 5-(4-hydroxyphenyl)-6-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide Traditional Name: 5-(4-hydroxyphenyl)-6-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide Formula: C17H19BrNO3- MolecularWeight: 365.24166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CNCCC2=CC(=C1O)O)C3=CC=C(C=C3)O.[Br-]

Isomeric SMILES

CC1=C2C(CNCCC2=CC(=C1O)O)C3=CC=C(C=C3)O.[Br-]

InChI

InChI=1S/C17H19NO3.BrH/c1-10-16-12(8-15(20)17(10)21)6-7-18-9-14(16)11-2-4-13(19)5-3-11;/h2-5,8,14,18-21H,6-7,9H2,1H3;1H/p-1