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

Systemtic Name: 2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]-N,N-dimethyl-ethanamine Openeye Name: 2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]-N,N-dimethyl-ethanamine CAS Name: 2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)thio]-N,N-dimethylethanamine IUPAC Name: 2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)sulfanyl]-N,N-dimethylethanamine Traditional Name: 2-[(2-ethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)thio]ethyl-dimethyl-amine Formula: C20H25NOS MolecularWeight: 327.4836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NOS/c1-4-15-9-10-19-18(13-15)20(23-12-11-21(2)3)17-8-6-5-7-16(17)14-22-19/h5-10,13,20H,4,11-12,14H2,1-3H3