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

Systemtic Name: 1-[2-[(4-chloranylphenoxy)methyl]-1-methyl-indol-3-yl]-2-(4-piperidin-1-ylpiperidin-1-yl)ethanone Openeye Name: 1-[2-[(4-chlorophenoxy)methyl]-1-methyl-indol-3-yl]-2-[4-(1-piperidyl)-1-piperidyl]ethanone CAS Name: 1-[2-[(4-chlorophenoxy)methyl]-1-methyl-3-indolyl]-2-[4-(1-piperidinyl)-1-piperidinyl]ethanone IUPAC Name: 1-[2-[(4-chlorophenoxy)methyl]-1-methylindol-3-yl]-2-(4-piperidin-1-ylpiperidin-1-yl)ethanone Traditional Name: 1-[2-[(4-chlorophenoxy)methyl]-1-methyl-indol-3-yl]-2-(4-piperidinopiperidino)ethanone Formula: C28H34ClN3O2 MolecularWeight: 480.04146

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1COC3=CC=C(C=C3)Cl)C(=O)CN4CCC(CC4)N5CCCCC5

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1COC3=CC=C(C=C3)Cl)C(=O)CN4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C28H34ClN3O2/c1-30-25-8-4-3-7-24(25)28(26(30)20-34-23-11-9-21(29)10-12-23)27(33)19-31-17-13-22(14-18-31)32-15-5-2-6-16-32/h3-4,7-12,22H,2,5-6,13-20H2,1H3