4-[(4-chlorophenyl)methyl]-9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-[(4-chlorophenyl)methyl]-9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(4-chlorophenyl)methyl]-9-methoxy-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[(4-chlorophenyl)methyl]-9-methoxy-7-(3-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(4-chlorophenyl)methyl]-9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(4-chlorobenzyl)-9-methoxy-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C22H21ClN2O2 MolecularWeight: 380.86734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCN(C2)CC3=CC=C(C=C3)Cl)C4=CN=CC=C4

Isomeric SMILES

COC1=CC(=CC2=C1OCCN(C2)CC3=CC=C(C=C3)Cl)C4=CN=CC=C4

InChI

InChI=1S/C22H21ClN2O2/c1-26-21-12-18(17-3-2-8-24-13-17)11-19-15-25(9-10-27-22(19)21)14-16-4-6-20(23)7-5-16/h2-8,11-13H,9-10,14-15H2,1H3