[4-(pyridin-4-ylmethoxy)phenyl] 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate

Systemtic Name: [4-(pyridin-4-ylmethoxy)phenyl] 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate Openeye Name: [4-(4-pyridylmethoxy)phenyl] 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate CAS Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid [4-(pyridin-4-ylmethoxy)phenyl] ester IUPAC Name: [4-(pyridin-4-ylmethoxy)phenyl] 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate Traditional Name: 2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid [4-(4-pyridylmethoxy)phenyl] ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)OC3=CC=C(C=C3)OCC4=CC=NC=C4

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)OC3=CC=C(C=C3)OCC4=CC=NC=C4

InChI

InChI=1S/C23H20N2O5/c26-22-11-14-28-21-4-2-1-3-20(21)25(22)15-23(27)30-19-7-5-18(6-8-19)29-16-17-9-12-24-13-10-17/h1-10,12-13H,11,14-16H2