2-[4-[2-(4-chlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]ethyl-ethyl-azanium chloride

Systemtic Name: 2-[4-[2-(4-chlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]ethyl-ethyl-azanium chloride Openeye Name: 2-[4-[2-(4-chlorophenyl)tetralin-1-yl]phenoxy]ethyl-ethyl-ammonium chloride CAS Name: 2-[4-[2-(4-chlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]ethyl-ethylammonium chloride IUPAC Name: 2-[4-[2-(4-chlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]ethyl-ethylazanium chloride Traditional Name: 2-[4-[2-(4-chlorophenyl)tetralin-1-yl]phenoxy]ethyl-ethyl-ammonium chloride Formula: C26H29Cl2NO MolecularWeight: 442.42056

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CCOC1=CC=C(C=C1)C2C(CCC3=CC=CC=C23)C4=CC=C(C=C4)Cl.[Cl-]

Isomeric SMILES

CC[NH2+]CCOC1=CC=C(C=C1)C2C(CCC3=CC=CC=C23)C4=CC=C(C=C4)Cl.[Cl-]

InChI

InChI=1S/C26H28ClNO.ClH/c1-2-28-17-18-29-23-14-9-21(10-15-23)26-24-6-4-3-5-19(24)11-16-25(26)20-7-12-22(27)13-8-20;/h3-10,12-15,25-26,28H,2,11,16-18H2,1H3;1H