ethyl 3-acetyloxy-5-bromanyl-1-(phenylmethyl)indole-2-carboxylate

Systemtic Name: ethyl 3-acetyloxy-5-bromanyl-1-(phenylmethyl)indole-2-carboxylate Openeye Name: ethyl 3-acetoxy-1-benzyl-5-bromo-indole-2-carboxylate CAS Name: 3-acetyloxy-5-bromo-1-(phenylmethyl)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-acetyloxy-1-benzyl-5-bromoindole-2-carboxylate Traditional Name: 3-acetoxy-1-benzyl-5-bromo-indole-2-carboxylic acid ethyl ester Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)Br)OC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)Br)OC(=O)C

InChI

InChI=1S/C20H18BrNO4/c1-3-25-20(24)18-19(26-13(2)23)16-11-15(21)9-10-17(16)22(18)12-14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3