ethyl 3-[1-(4-methylphenyl)sulfonyl-3-phenyl-propyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[1-(4-methylphenyl)sulfonyl-3-phenyl-propyl]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[3-phenyl-1-(p-tolylsulfonyl)propyl]-1H-indole-2-carboxylate CAS Name: 3-[1-(4-methylphenyl)sulfonyl-3-phenylpropyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[1-(4-methylphenyl)sulfonyl-3-phenylpropyl]-1H-indole-2-carboxylate Traditional Name: 3-(3-phenyl-1-tosyl-propyl)-1H-indole-2-carboxylic acid ethyl ester Formula: C27H27NO4S MolecularWeight: 461.57258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1)C(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1)C(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H27NO4S/c1-3-32-27(29)26-25(22-11-7-8-12-23(22)28-26)24(18-15-20-9-5-4-6-10-20)33(30,31)21-16-13-19(2)14-17-21/h4-14,16-17,24,28H,3,15,18H2,1-2H3