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

Systemtic Name: 2-[2,5,5-trimethyl-3-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]-6,7-dihydro-4H-indol-1-yl]ethanoic acid Openeye Name: 2-[2,5,5-trimethyl-3-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]-6,7-dihydro-4H-indol-1-yl]acetic acid CAS Name: 2-[2,5,5-trimethyl-3-[[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-ylsulfonylphenyl)methyl]-6,7-dihydro-4H-indol-1-yl]acetic acid Traditional Name: 2-[2,5,5-trimethyl-3-(4-pyrrolidinosulfonylbenzyl)-6,7-dihydro-4H-indol-1-yl]acetic acid Formula: C24H32N2O4S MolecularWeight: 444.58688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)CCC(C2)(C)C)CC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)CCC(C2)(C)C)CC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H32N2O4S/c1-17-20(21-15-24(2,3)11-10-22(21)26(17)16-23(27)28)14-18-6-8-19(9-7-18)31(29,30)25-12-4-5-13-25/h6-9H,4-5,10-16H2,1-3H3,(H,27,28)