3-chloranyl-2-(3,4-dimethoxyphenyl)-5-phenyl-1-benzoxepine

Systemtic Name: 3-chloranyl-2-(3,4-dimethoxyphenyl)-5-phenyl-1-benzoxepine Openeye Name: 3-chloro-2-(3,4-dimethoxyphenyl)-5-phenyl-1-benzoxepine CAS Name: 3-chloro-2-(3,4-dimethoxyphenyl)-5-phenyl-1-benzoxepin IUPAC Name: 3-chloro-2-(3,4-dimethoxyphenyl)-5-phenyl-1-benzoxepine Traditional Name: 3-chloro-2-(3,4-dimethoxyphenyl)-5-phenyl-1-benzoxepin Formula: C24H19ClO3 MolecularWeight: 390.85886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=C(C3=CC=CC=C3O2)C4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=C(C3=CC=CC=C3O2)C4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C24H19ClO3/c1-26-22-13-12-17(14-23(22)27-2)24-20(25)15-19(16-8-4-3-5-9-16)18-10-6-7-11-21(18)28-24/h3-15H,1-2H3