ethyl 6-bromanyl-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenyl-indole-3-carboxylate CAS Name: 6-bromo-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenylindole-3-carboxylate Traditional Name: 6-bromo-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C25H21BrClNO5S MolecularWeight: 562.85994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21BrClNO5S/c1-3-33-25(29)24-19-13-23(32-2)20(26)14-21(19)28(17-7-5-4-6-8-17)22(24)15-34(30,31)18-11-9-16(27)10-12-18/h4-14H,3,15H2,1-2H3