4-[(2-fluoranyl-4-methoxy-phenyl)methyl]-9-methoxy-7-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-[(2-fluoranyl-4-methoxy-phenyl)methyl]-9-methoxy-7-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(2-fluoro-4-methoxy-phenyl)methyl]-9-methoxy-7-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[(2-fluoro-4-methoxyphenyl)methyl]-9-methoxy-7-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(2-fluoro-4-methoxyphenyl)methyl]-9-methoxy-7-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(2-fluoro-4-methoxy-benzyl)-9-methoxy-7-(4-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C25H26FNO4 MolecularWeight: 423.476643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=C(C=C(C=C4)OC)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=C(C=C(C=C4)OC)F

InChI

InChI=1S/C25H26FNO4/c1-28-21-7-4-17(5-8-21)19-12-20-16-27(10-11-31-25(20)24(13-19)30-3)15-18-6-9-22(29-2)14-23(18)26/h4-9,12-14H,10-11,15-16H2,1-3H3