ethyl 5-acetyloxy-6-bromanyl-1-methyl-2-[(2-methylimidazol-1-yl)methyl]indole-3-carboxylate

Systemtic Name: ethyl 5-acetyloxy-6-bromanyl-1-methyl-2-[(2-methylimidazol-1-yl)methyl]indole-3-carboxylate Openeye Name: ethyl 5-acetoxy-6-bromo-1-methyl-2-[(2-methylimidazol-1-yl)methyl]indole-3-carboxylate CAS Name: 5-acetyloxy-6-bromo-1-methyl-2-[(2-methyl-1-imidazolyl)methyl]-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyloxy-6-bromo-1-methyl-2-[(2-methylimidazol-1-yl)methyl]indole-3-carboxylate Traditional Name: 5-acetoxy-6-bromo-1-methyl-2-[(2-methylimidazol-1-yl)methyl]indole-3-carboxylic acid ethyl ester Formula: C19H20BrN3O4 MolecularWeight: 434.2838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C)CN3C=CN=C3C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C)CN3C=CN=C3C

InChI

InChI=1S/C19H20BrN3O4/c1-5-26-19(25)18-13-8-17(27-12(3)24)14(20)9-15(13)22(4)16(18)10-23-7-6-21-11(23)2/h6-9H,5,10H2,1-4H3