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

Systemtic Name: 4-[(2,4-dimethylphenyl)methyl]-9-methoxy-7-(6-methoxypyridin-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(2,4-dimethylphenyl)methyl]-9-methoxy-7-(6-methoxy-2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[(2,4-dimethylphenyl)methyl]-9-methoxy-7-(6-methoxy-2-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(2,4-dimethylphenyl)methyl]-9-methoxy-7-(6-methoxypyridin-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(2,4-dimethylbenzyl)-9-methoxy-7-(6-methoxy-2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CC=C4)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CC=C4)OC)C

InChI

InChI=1S/C25H28N2O3/c1-17-8-9-19(18(2)12-17)15-27-10-11-30-25-21(16-27)13-20(14-23(25)28-3)22-6-5-7-24(26-22)29-4/h5-9,12-14H,10-11,15-16H2,1-4H3