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

Systemtic Name: 9-methoxy-7-(6-methoxypyridazin-3-yl)-4-[(3-phenylmethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(3-benzyloxyphenyl)methyl]-9-methoxy-7-(6-methoxypyridazin-3-yl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 9-methoxy-7-(6-methoxy-3-pyridazinyl)-4-[(3-phenylmethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 9-methoxy-7-(6-methoxypyridazin-3-yl)-4-[(3-phenylmethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(3-benzoxybenzyl)-9-methoxy-7-(6-methoxypyridazin-3-yl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C29H29N3O4 MolecularWeight: 483.55826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=NN=C(C=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H29N3O4/c1-33-27-17-23(26-11-12-28(34-2)31-30-26)16-24-19-32(13-14-35-29(24)27)18-22-9-6-10-25(15-22)36-20-21-7-4-3-5-8-21/h3-12,15-17H,13-14,18-20H2,1-2H3