[7-(3-chlorophenyl)-9-(oxan-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-pyridin-2-yl-methanone

Systemtic Name: [7-(3-chlorophenyl)-9-(oxan-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-pyridin-2-yl-methanone Openeye Name: [7-(3-chlorophenyl)-9-(tetrahydropyran-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-pyridyl)methanone CAS Name: [7-(3-chlorophenyl)-9-(2-oxanylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-pyridinyl)methanone IUPAC Name: [7-(3-chlorophenyl)-9-(oxan-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-pyridin-2-ylmethanone Traditional Name: [7-(3-chlorophenyl)-9-(tetrahydropyran-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-pyridyl)methanone Formula: C27H27ClN2O4 MolecularWeight: 478.96728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)COC2=CC(=CC3=C2OCCN(C3)C(=O)C4=CC=CC=N4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CCOC(C1)COC2=CC(=CC3=C2OCCN(C3)C(=O)C4=CC=CC=N4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C27H27ClN2O4/c28-22-7-5-6-19(15-22)20-14-21-17-30(27(31)24-9-1-3-10-29-24)11-13-33-26(21)25(16-20)34-18-23-8-2-4-12-32-23/h1,3,5-7,9-10,14-16,23H,2,4,8,11-13,17-18H2