2-[(2-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)oxy]-N,N-dimethyl-ethanamine

Systemtic Name: 2-[(2-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)oxy]-N,N-dimethyl-ethanamine Openeye Name: 2-[(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)oxy]-N,N-dimethyl-ethanamine CAS Name: 2-[(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)oxy]-N,N-dimethylethanamine IUPAC Name: 2-[(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)oxy]-N,N-dimethylethanamine Traditional Name: 2-[(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)oxy]ethyl-dimethyl-amine Formula: C18H20ClNOS MolecularWeight: 333.8755

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1CC2=CC=CC=C2SC3=C1C=CC(=C3)Cl

Isomeric SMILES

CN(C)CCOC1CC2=CC=CC=C2SC3=C1C=CC(=C3)Cl

InChI

InChI=1S/C18H20ClNOS/c1-20(2)9-10-21-16-11-13-5-3-4-6-17(13)22-18-12-14(19)7-8-15(16)18/h3-8,12,16H,9-11H2,1-2H3