4-(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxidanylidene-N-(pyridin-4-ylmethyl)butanamide

Systemtic Name: 4-(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxidanylidene-N-(pyridin-4-ylmethyl)butanamide Openeye Name: 4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxo-N-(4-pyridylmethyl)butanamide CAS Name: 4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxo-N-(pyridin-4-ylmethyl)butanamide IUPAC Name: 4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-oxo-N-(pyridin-4-ylmethyl)butanamide Traditional Name: 4-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-4-keto-N-(4-pyridylmethyl)butyramide Formula: C23H20ClN3O3 MolecularWeight: 421.8762

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C(N1C(=O)CCC(=O)NCC4=CC=NC=C4)C=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2OC3=C(N1C(=O)CCC(=O)NCC4=CC=NC=C4)C=C(C=C3)Cl

InChI

InChI=1S/C23H20ClN3O3/c24-18-5-6-21-19(13-18)27(15-17-3-1-2-4-20(17)30-21)23(29)8-7-22(28)26-14-16-9-11-25-12-10-16/h1-6,9-13H,7-8,14-15H2,(H,26,28)