6-(2-bromanylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 6-(2-bromanylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-(2-bromophenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-(2-bromophenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-(2-bromophenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-(2-bromophenoxy)-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid Formula: C20H15BrN2O4 MolecularWeight: 427.2481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C3=C(C=CC(=C3)OC4=CC=CC=C4Br)NC2=CN=C1C(=O)O

Isomeric SMILES

COCC1=C2C3=C(C=CC(=C3)OC4=CC=CC=C4Br)NC2=CN=C1C(=O)O

InChI

InChI=1S/C20H15BrN2O4/c1-26-10-13-18-12-8-11(27-17-5-3-2-4-14(17)21)6-7-15(12)23-16(18)9-22-19(13)20(24)25/h2-9,23H,10H2,1H3,(H,24,25)