ethyl 6-bromanyl-1-(3-chlorophenyl)-2-methyl-5-prop-2-enoxy-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-(3-chlorophenyl)-2-methyl-5-prop-2-enoxy-indole-3-carboxylate Openeye Name: ethyl 5-allyloxy-6-bromo-1-(3-chlorophenyl)-2-methyl-indole-3-carboxylate CAS Name: 6-bromo-1-(3-chlorophenyl)-2-methyl-5-prop-2-enoxy-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-(3-chlorophenyl)-2-methyl-5-prop-2-enoxyindole-3-carboxylate Traditional Name: 5-allyloxy-6-bromo-1-(3-chlorophenyl)-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C21H19BrClNO3 MolecularWeight: 448.73746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OCC=C)Br)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OCC=C)Br)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C21H19BrClNO3/c1-4-9-27-19-11-16-18(12-17(19)22)24(15-8-6-7-14(23)10-15)13(3)20(16)21(25)26-5-2/h4,6-8,10-12H,1,5,9H2,2-3H3