3-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-1-ylmethyl)-1-methyl-piperidine

Systemtic Name: 3-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-1-ylmethyl)-1-methyl-piperidine Openeye Name: 3-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-1-ylmethyl)-1-methyl-piperidine CAS Name: 3-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-1-ylmethyl)-1-methylpiperidine IUPAC Name: 3-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-1-ylmethyl)-1-methylpiperidine Traditional Name: 3-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-1-ylmethyl)-1-methyl-piperidine Formula: C20H25NOS MolecularWeight: 327.4836

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)CC2CC=CC3=C2SC4C=CC=CC4=CO3

Isomeric SMILES

CN1CCCC(C1)CC2CC=CC3=C2SC4C=CC=CC4=CO3

InChI

InChI=1S/C20H25NOS/c1-21-11-5-6-15(13-21)12-16-8-4-9-18-20(16)23-19-10-3-2-7-17(19)14-22-18/h2-4,7,9-10,14-16,19H,5-6,8,11-13H2,1H3