4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol

Systemtic Name: 4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 4-[(4-methoxy-2,5-dimethylphenyl)methyl]-7-(3-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 4-[(4-methoxy-2,5-dimethylphenyl)methyl]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 4-(4-methoxy-2,5-dimethyl-benzyl)-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCOC3=C(C2)C=C(C=C3O)C4=CN=CC=C4)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCOC3=C(C2)C=C(C=C3O)C4=CN=CC=C4)C)OC

InChI

InChI=1S/C24H26N2O3/c1-16-10-23(28-3)17(2)9-20(16)14-26-7-8-29-24-21(15-26)11-19(12-22(24)27)18-5-4-6-25-13-18/h4-6,9-13,27H,7-8,14-15H2,1-3H3