1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-2-methyl-indole

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-2-methyl-indole Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-3-[1-(4-ethylphenyl)sulfonyl-4-piperidyl]-2-methyl-indole CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3-[1-(4-ethylphenyl)sulfonyl-4-piperidinyl]-2-methylindole IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-2-methylindole Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-3-[1-(4-ethylphenyl)sulfonyl-4-piperidyl]-2-methyl-indole Formula: C29H30ClFN2O2S MolecularWeight: 525.077103

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=C(N(C4=CC=CC=C43)CC5=C(C=CC=C5Cl)F)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=C(N(C4=CC=CC=C43)CC5=C(C=CC=C5Cl)F)C

InChI

InChI=1S/C29H30ClFN2O2S/c1-3-21-11-13-23(14-12-21)36(34,35)32-17-15-22(16-18-32)29-20(2)33(28-10-5-4-7-24(28)29)19-25-26(30)8-6-9-27(25)31/h4-14,22H,3,15-19H2,1-2H3