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

Systemtic Name: methyl 1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]indole-2-carboxylate Openeye Name: methyl 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]indole-2-carboxylate CAS Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-2-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]indole-2-carboxylate Traditional Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]indole-2-carboxylic acid methyl ester Formula: C18H14BrNO4 MolecularWeight: 388.21206

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=CC=CC=C2N1CC3=CC4=C(C=C3Br)OCO4

Isomeric SMILES

COC(=O)C1=CC2=CC=CC=C2N1CC3=CC4=C(C=C3Br)OCO4

InChI

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