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

Systemtic Name: methyl 2-(6-bromanyl-1-methyl-indol-3-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)ethanoate Openeye Name: methyl 2-(6-bromo-1-methyl-indol-3-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)acetate CAS Name: 2-(6-bromo-1-methyl-3-indolyl)-2-(7-methoxy-1,3-benzodioxol-5-yl)acetic acid methyl ester IUPAC Name: methyl 2-(6-bromo-1-methylindol-3-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)acetate Traditional Name: 2-(6-bromo-1-methyl-indol-3-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)acetic acid methyl ester Formula: C20H18BrNO5 MolecularWeight: 432.26462

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=C(C=C2)Br)C(C3=CC4=C(C(=C3)OC)OCO4)C(=O)OC

Isomeric SMILES

CN1C=C(C2=C1C=C(C=C2)Br)C(C3=CC4=C(C(=C3)OC)OCO4)C(=O)OC

InChI

InChI=1S/C20H18BrNO5/c1-22-9-14(13-5-4-12(21)8-15(13)22)18(20(23)25-3)11-6-16(24-2)19-17(7-11)26-10-27-19/h4-9,18H,10H2,1-3H3