4-[(2,4-dimethoxyphenyl)methyl]-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol

Systemtic Name: 4-[(2,4-dimethoxyphenyl)methyl]-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 4-[(2,4-dimethoxyphenyl)methyl]-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 4-[(2,4-dimethoxyphenyl)methyl]-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 4-[(2,4-dimethoxyphenyl)methyl]-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 4-(2,4-dimethoxybenzyl)-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCOC3=C(C2)C=C(C=C3O)C4=CC=CS4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCOC3=C(C2)C=C(C=C3O)C4=CC=CS4)OC

InChI

InChI=1S/C22H23NO4S/c1-25-18-6-5-15(20(12-18)26-2)13-23-7-8-27-22-17(14-23)10-16(11-19(22)24)21-4-3-9-28-21/h3-6,9-12,24H,7-8,13-14H2,1-2H3