2-[(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-(2-hydroxyethyl)amino]ethanol

Systemtic Name: 2-[(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-(2-hydroxyethyl)amino]ethanol Openeye Name: 2-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-(2-hydroxyethyl)amino]ethanol CAS Name: 2-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-(2-hydroxyethyl)amino]ethanol IUPAC Name: 2-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-(2-hydroxyethyl)amino]ethanol Traditional Name: 2-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-(2-hydroxyethyl)amino]ethanol Formula: C18H20ClNO2S MolecularWeight: 349.8749

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC(=C2)Cl)SC3=CC=CC=C31)N(CCO)CCO

Isomeric SMILES

C1C(C2=C(C=CC(=C2)Cl)SC3=CC=CC=C31)N(CCO)CCO

InChI

InChI=1S/C18H20ClNO2S/c19-14-5-6-18-15(12-14)16(20(7-9-21)8-10-22)11-13-3-1-2-4-17(13)23-18/h1-6,12,16,21-22H,7-11H2