3-[1-[(4-chlorophenyl)methyl]-5-propan-2-yl-3-sulfonyl-2H-indol-2-yl]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]-5-propan-2-yl-3-sulfonyl-2H-indol-2-yl]-2,2-dimethyl-propanoic acid Openeye Name: 3-[1-[(4-chlorophenyl)methyl]-5-isopropyl-3-sulfonyl-indolin-2-yl]-2,2-dimethyl-propanoic acid CAS Name: 3-[1-[(4-chlorophenyl)methyl]-5-propan-2-yl-3-sulfonyl-2H-indol-2-yl]-2,2-dimethylpropanoic acid IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]-5-propan-2-yl-3-sulfonyl-2H-indol-2-yl]-2,2-dimethylpropanoic acid Traditional Name: 3-[1-(4-chlorobenzyl)-5-isopropyl-3-sulfonyl-indolin-2-yl]-2,2-dimethyl-propionic acid Formula: C23H26ClNO4S MolecularWeight: 447.97484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(C2=S(=O)=O)CC(C)(C)C(=O)O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(C2=S(=O)=O)CC(C)(C)C(=O)O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H26ClNO4S/c1-14(2)16-7-10-19-18(11-16)21(30(28)29)20(12-23(3,4)22(26)27)25(19)13-15-5-8-17(24)9-6-15/h5-11,14,20H,12-13H2,1-4H3,(H,26,27)