(6-bromanyl-1,3-benzodioxol-5-yl)methyl 1-methylindole-3-carboxylate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 1-methylindole-3-carboxylate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 1-methylindole-3-carboxylate CAS Name: 1-methyl-3-indolecarboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 1-methylindole-3-carboxylate Traditional Name: 1-methylindole-3-carboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C18H14BrNO4 MolecularWeight: 388.21206

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)OCC3=CC4=C(C=C3Br)OCO4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)OCC3=CC4=C(C=C3Br)OCO4

InChI

InChI=1S/C18H14BrNO4/c1-20-8-13(12-4-2-3-5-15(12)20)18(21)22-9-11-6-16-17(7-14(11)19)24-10-23-16/h2-8H,9-10H2,1H3