methyl 2-(6-bromanyl-1H-indol-2-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)ethanoate

Systemtic Name: methyl 2-(6-bromanyl-1H-indol-2-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)ethanoate Openeye Name: methyl 2-(6-bromo-1H-indol-2-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)acetate CAS Name: 2-(6-bromo-1H-indol-2-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)acetic acid methyl ester IUPAC Name: methyl 2-(6-bromo-1H-indol-2-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)acetate Traditional Name: 2-(6-bromo-1H-indol-2-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)acetic acid methyl ester Formula: C19H16BrNO5 MolecularWeight: 418.23804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C(C3=CC4=C(N3)C=C(C=C4)Br)C(=O)OC

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C(C3=CC4=C(N3)C=C(C=C4)Br)C(=O)OC

InChI

InChI=1S/C19H16BrNO5/c1-23-15-6-11(7-16-18(15)26-9-25-16)17(19(22)24-2)14-5-10-3-4-12(20)8-13(10)21-14/h3-8,17,21H,9H2,1-2H3