1-[2-[(4-chloranylphenoxy)methyl]-5-fluoranyl-1-methyl-indol-3-yl]-2-(4-piperidin-1-ylpiperidin-1-yl)ethanone

Systemtic Name: 1-[2-[(4-chloranylphenoxy)methyl]-5-fluoranyl-1-methyl-indol-3-yl]-2-(4-piperidin-1-ylpiperidin-1-yl)ethanone Openeye Name: 1-[2-[(4-chlorophenoxy)methyl]-5-fluoro-1-methyl-indol-3-yl]-2-[4-(1-piperidyl)-1-piperidyl]ethanone CAS Name: 1-[2-[(4-chlorophenoxy)methyl]-5-fluoro-1-methyl-3-indolyl]-2-[4-(1-piperidinyl)-1-piperidinyl]ethanone IUPAC Name: 1-[2-[(4-chlorophenoxy)methyl]-5-fluoro-1-methylindol-3-yl]-2-(4-piperidin-1-ylpiperidin-1-yl)ethanone Traditional Name: 1-[2-[(4-chlorophenoxy)methyl]-5-fluoro-1-methyl-indol-3-yl]-2-(4-piperidinopiperidino)ethanone Formula: C28H33ClFN3O2 MolecularWeight: 498.031923

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)F)C(=C1COC3=CC=C(C=C3)Cl)C(=O)CN4CCC(CC4)N5CCCCC5

Isomeric SMILES

CN1C2=C(C=C(C=C2)F)C(=C1COC3=CC=C(C=C3)Cl)C(=O)CN4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C28H33ClFN3O2/c1-31-25-10-7-21(30)17-24(25)28(26(31)19-35-23-8-5-20(29)6-9-23)27(34)18-32-15-11-22(12-16-32)33-13-3-2-4-14-33/h5-10,17,22H,2-4,11-16,18-19H2,1H3