2-[5-chloranyl-3-[1-(4-propan-2-yloxyphenyl)sulfonylpiperidin-4-yl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-3-[1-(4-propan-2-yloxyphenyl)sulfonylpiperidin-4-yl]indol-1-yl]ethanoic acid Openeye Name: 2-[5-chloro-3-[1-(4-isopropoxyphenyl)sulfonyl-4-piperidyl]indol-1-yl]acetic acid CAS Name: 2-[5-chloro-3-[1-(4-propan-2-yloxyphenyl)sulfonyl-4-piperidinyl]-1-indolyl]acetic acid IUPAC Name: 2-[5-chloro-3-[1-(4-propan-2-yloxyphenyl)sulfonylpiperidin-4-yl]indol-1-yl]acetic acid Traditional Name: 2-[5-chloro-3-[1-(4-isopropoxyphenyl)sulfonyl-4-piperidyl]indol-1-yl]acetic acid Formula: C24H27ClN2O5S MolecularWeight: 490.99958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CN(C4=C3C=C(C=C4)Cl)CC(=O)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CN(C4=C3C=C(C=C4)Cl)CC(=O)O

InChI

InChI=1S/C24H27ClN2O5S/c1-16(2)32-19-4-6-20(7-5-19)33(30,31)27-11-9-17(10-12-27)22-14-26(15-24(28)29)23-8-3-18(25)13-21(22)23/h3-8,13-14,16-17H,9-12,15H2,1-2H3,(H,28,29)