2-[2,5,5-trimethyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-6,7-dihydro-4H-indol-1-yl]ethanoic acid

Systemtic Name: 2-[2,5,5-trimethyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-6,7-dihydro-4H-indol-1-yl]ethanoic acid Openeye Name: 2-[2,5,5-trimethyl-3-(4-pyrrolidin-1-ylsulfonylbenzoyl)-6,7-dihydro-4H-indol-1-yl]acetic acid CAS Name: 2-[2,5,5-trimethyl-3-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-6,7-dihydro-4H-indol-1-yl]acetic acid IUPAC Name: 2-[2,5,5-trimethyl-3-(4-pyrrolidin-1-ylsulfonylbenzoyl)-6,7-dihydro-4H-indol-1-yl]acetic acid Traditional Name: 2-[2,5,5-trimethyl-3-(4-pyrrolidinosulfonylbenzoyl)-6,7-dihydro-4H-indol-1-yl]acetic acid Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)CCC(C2)(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)CCC(C2)(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H30N2O5S/c1-16-22(19-14-24(2,3)11-10-20(19)26(16)15-21(27)28)23(29)17-6-8-18(9-7-17)32(30,31)25-12-4-5-13-25/h6-9H,4-5,10-15H2,1-3H3,(H,27,28)