ethyl 6-bromanyl-4-(dimethylaminomethyl)-1-methyl-5-oxidanyl-2-(1-phenylethylsulfonylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-(dimethylaminomethyl)-1-methyl-5-oxidanyl-2-(1-phenylethylsulfonylmethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-methyl-2-(1-phenylethylsulfonylmethyl)indole-3-carboxylate CAS Name: 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-methyl-2-(1-phenylethylsulfonylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-methyl-2-(1-phenylethylsulfonylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-4-(dimethylaminomethyl)-5-hydroxy-1-methyl-2-(1-phenylethylsulfonylmethyl)indole-3-carboxylic acid ethyl ester Formula: C24H29BrN2O5S MolecularWeight: 537.46646

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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)C)CS(=O)(=O)C(C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C24H29BrN2O5S/c1-6-32-24(29)22-20(14-33(30,31)15(2)16-10-8-7-9-11-16)27(5)19-12-18(25)23(28)17(21(19)22)13-26(3)4/h7-12,15,28H,6,13-14H2,1-5H3