N,N-diethyl-2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethanamine

Systemtic Name: N,N-diethyl-2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethanamine Openeye Name: N,N-diethyl-2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethanamine CAS Name: N,N-diethyl-2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)thio]ethanamine IUPAC Name: N,N-diethyl-2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]ethanamine Traditional Name: diethyl-[2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)thio]ethyl]amine Formula: C22H29NOS MolecularWeight: 355.53676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OCC3=CC=CC=C3C2SCCN(CC)CC

Isomeric SMILES

CCC1=CC2=C(C=C1)OCC3=CC=CC=C3C2SCCN(CC)CC

InChI

InChI=1S/C22H29NOS/c1-4-17-11-12-21-20(15-17)22(25-14-13-23(5-2)6-3)19-10-8-7-9-18(19)16-24-21/h7-12,15,22H,4-6,13-14,16H2,1-3H3