(3,4-dimethylphenyl) 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: (3,4-dimethylphenyl) 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: (3,4-dimethylphenyl) 1-methylsulfonylindoline-5-carboxylate CAS Name: 1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: 1-mesylindoline-5-carboxylic acid (3,4-dimethylphenyl) ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C)C

InChI

InChI=1S/C18H19NO4S/c1-12-4-6-16(10-13(12)2)23-18(20)15-5-7-17-14(11-15)8-9-19(17)24(3,21)22/h4-7,10-11H,8-9H2,1-3H3