4-[(2-fluoranyl-4-methoxy-phenyl)methyl]-9-methoxy-7-(6-methoxypyridin-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-[(2-fluoranyl-4-methoxy-phenyl)methyl]-9-methoxy-7-(6-methoxypyridin-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(2-fluoro-4-methoxy-phenyl)methyl]-9-methoxy-7-(6-methoxy-2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[(2-fluoro-4-methoxyphenyl)methyl]-9-methoxy-7-(6-methoxy-2-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(2-fluoro-4-methoxyphenyl)methyl]-9-methoxy-7-(6-methoxypyridin-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(2-fluoro-4-methoxy-benzyl)-9-methoxy-7-(6-methoxy-2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C24H25FN2O4 MolecularWeight: 424.464703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CC=C4)OC)F

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CC=C4)OC)F

InChI

InChI=1S/C24H25FN2O4/c1-28-19-8-7-16(20(25)13-19)14-27-9-10-31-24-18(15-27)11-17(12-22(24)29-2)21-5-4-6-23(26-21)30-3/h4-8,11-13H,9-10,14-15H2,1-3H3