3-chloranyl-4-[4-(4-quinazolin-4-ylpiperazin-1-yl)butyl]-1,4-benzoxazepin-5-one

Systemtic Name: 3-chloranyl-4-[4-(4-quinazolin-4-ylpiperazin-1-yl)butyl]-1,4-benzoxazepin-5-one Openeye Name: 3-chloro-4-[4-(4-quinazolin-4-ylpiperazin-1-yl)butyl]-1,4-benzoxazepin-5-one CAS Name: 3-chloro-4-[4-[4-(4-quinazolinyl)-1-piperazinyl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 3-chloro-4-[4-(4-quinazolin-4-ylpiperazin-1-yl)butyl]-1,4-benzoxazepin-5-one Traditional Name: 3-chloro-4-[4-(4-quinazolin-4-ylpiperazino)butyl]-1,4-benzoxazepin-5-one Formula: C25H26ClN5O2 MolecularWeight: 463.95924

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=COC3=CC=CC=C3C2=O)Cl)C4=NC=NC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCCCN2C(=COC3=CC=CC=C3C2=O)Cl)C4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C25H26ClN5O2/c26-23-17-33-22-10-4-2-8-20(22)25(32)31(23)12-6-5-11-29-13-15-30(16-14-29)24-19-7-1-3-9-21(19)27-18-28-24/h1-4,7-10,17-18H,5-6,11-16H2