3-[1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]-1-[(3-methoxyphenyl)methyl]-2-methyl-indole

Systemtic Name: 3-[1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]-1-[(3-methoxyphenyl)methyl]-2-methyl-indole Openeye Name: 3-[1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-piperidyl]-1-[(3-methoxyphenyl)methyl]-2-methyl-indole CAS Name: 3-[1-(3-chloro-4-fluorophenyl)sulfonyl-4-piperidinyl]-1-[(3-methoxyphenyl)methyl]-2-methylindole IUPAC Name: 3-[1-(3-chloro-4-fluorophenyl)sulfonylpiperidin-4-yl]-1-[(3-methoxyphenyl)methyl]-2-methylindole Traditional Name: 3-[1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-piperidyl]-1-m-anisyl-2-methyl-indole Formula: C28H28ClFN2O3S MolecularWeight: 527.049923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)OC)C4CCN(CC4)S(=O)(=O)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)OC)C4CCN(CC4)S(=O)(=O)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C28H28ClFN2O3S/c1-19-28(21-12-14-31(15-13-21)36(33,34)23-10-11-26(30)25(29)17-23)24-8-3-4-9-27(24)32(19)18-20-6-5-7-22(16-20)35-2/h3-11,16-17,21H,12-15,18H2,1-2H3