N-[2-(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-2-oxidanylidene-ethyl]-3-pyridin-4-yl-propanamide

Systemtic Name: N-[2-(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)-2-oxidanylidene-ethyl]-3-pyridin-4-yl-propanamide Openeye Name: N-[2-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-2-oxo-ethyl]-3-(4-pyridyl)propanamide CAS Name: N-[2-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-2-oxoethyl]-3-pyridin-4-ylpropanamide IUPAC Name: N-[2-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-2-oxoethyl]-3-pyridin-4-ylpropanamide Traditional Name: N-[2-(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)-2-keto-ethyl]-3-(4-pyridyl)propionamide Formula: C23H20ClN3O3 MolecularWeight: 421.8762

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C(N1C(=O)CNC(=O)CCC4=CC=NC=C4)C=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2OC3=C(N1C(=O)CNC(=O)CCC4=CC=NC=C4)C=C(C=C3)Cl

InChI

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