3-chloranyl-2-(4-ethoxyphenyl)-5-(4-methylphenyl)-1-benzoxepine

Systemtic Name: 3-chloranyl-2-(4-ethoxyphenyl)-5-(4-methylphenyl)-1-benzoxepine Openeye Name: 3-chloro-2-(4-ethoxyphenyl)-5-(p-tolyl)-1-benzoxepine CAS Name: 3-chloro-2-(4-ethoxyphenyl)-5-(4-methylphenyl)-1-benzoxepin IUPAC Name: 3-chloro-2-(4-ethoxyphenyl)-5-(4-methylphenyl)-1-benzoxepine Traditional Name: 3-chloro-2-p-phenetyl-5-(p-tolyl)-1-benzoxepin Formula: C25H21ClO2 MolecularWeight: 388.88604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(C=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(C=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C)Cl

InChI

InChI=1S/C25H21ClO2/c1-3-27-20-14-12-19(13-15-20)25-23(26)16-22(18-10-8-17(2)9-11-18)21-6-4-5-7-24(21)28-25/h4-16H,3H2,1-2H3