(6-bromanyl-1,3-benzodioxol-5-yl)methyl 1H-indole-2-carboxylate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 1H-indole-2-carboxylate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 1H-indole-2-carboxylate CAS Name: 1H-indole-2-carboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 1H-indole-2-carboxylate Traditional Name: 1H-indole-2-carboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C17H12BrNO4 MolecularWeight: 374.18548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC4=CC=CC=C4N3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC4=CC=CC=C4N3)Br

InChI

InChI=1S/C17H12BrNO4/c18-12-7-16-15(22-9-23-16)6-11(12)8-21-17(20)14-5-10-3-1-2-4-13(10)19-14/h1-7,19H,8-9H2