4-bromanyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-bromanyl-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-bromo-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-bromo-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-bromo-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-bromo-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1H-pyrrole-2-carboxylic acid Formula: C17H19BrN2O4 MolecularWeight: 395.24776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1Br)C2C3=CC(=C(C=C3CCN2)OC)OC)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1Br)C2C3=CC(=C(C=C3CCN2)OC)OC)C(=O)O

InChI

InChI=1S/C17H19BrN2O4/c1-8-13(18)16(20-14(8)17(21)22)15-10-7-12(24-3)11(23-2)6-9(10)4-5-19-15/h6-7,15,19-20H,4-5H2,1-3H3,(H,21,22)