2-methyl-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-indole; propanoate

Systemtic Name: 2-methyl-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-indole; propanoate Openeye Name: 2-methyl-1-(2,4,6-triisopropylphenyl)sulfonyl-indole; propanoate CAS Name: 2-methyl-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonylindole; propanoate IUPAC Name: 2-methyl-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonylindole; propanoate Traditional Name: 2-methyl-1-(2,4,6-triisopropylphenyl)sulfonyl-indole; propionate Formula: C27H36NO4S- MolecularWeight: 470.64404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[O-].CC1=CC2=CC=CC=C2N1S(=O)(=O)C3=C(C=C(C=C3C(C)C)C(C)C)C(C)C

Isomeric SMILES

CCC(=O)[O-].CC1=CC2=CC=CC=C2N1S(=O)(=O)C3=C(C=C(C=C3C(C)C)C(C)C)C(C)C

InChI

InChI=1S/C24H31NO2S.C3H6O2/c1-15(2)20-13-21(16(3)4)24(22(14-20)17(5)6)28(26,27)25-18(7)12-19-10-8-9-11-23(19)25;1-2-3(4)5/h8-17H,1-7H3;2H2,1H3,(H,4,5)/p-1