ethyl 6-bromanyl-2,4-bis(dimethylaminomethyl)-5-oxidanyl-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2,4-bis(dimethylaminomethyl)-5-oxidanyl-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2,4-bis(dimethylaminomethyl)-5-hydroxy-1-phenyl-indole-3-carboxylate CAS Name: 6-bromo-2,4-bis(dimethylaminomethyl)-5-hydroxy-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2,4-bis(dimethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate Traditional Name: 6-bromo-2,4-bis(dimethylaminomethyl)-5-hydroxy-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C23H28BrN3O3 MolecularWeight: 474.39072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28BrN3O3/c1-6-30-23(29)21-19(14-26(4)5)27(15-10-8-7-9-11-15)18-12-17(24)22(28)16(20(18)21)13-25(2)3/h7-12,28H,6,13-14H2,1-5H3