3-chloranyl-4-(4-chloranylbutyl)-1,4-benzoxazepin-5-one

Systemtic Name: 3-chloranyl-4-(4-chloranylbutyl)-1,4-benzoxazepin-5-one Openeye Name: 3-chloro-4-(4-chlorobutyl)-1,4-benzoxazepin-5-one CAS Name: 3-chloro-4-(4-chlorobutyl)-1,4-benzoxazepin-5-one IUPAC Name: 3-chloro-4-(4-chlorobutyl)-1,4-benzoxazepin-5-one Traditional Name: 3-chloro-4-(4-chlorobutyl)-1,4-benzoxazepin-5-one Formula: C13H13Cl2NO2 MolecularWeight: 286.15382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=CO2)Cl)CCCCCl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=CO2)Cl)CCCCCl

InChI

InChI=1S/C13H13Cl2NO2/c14-7-3-4-8-16-12(15)9-18-11-6-2-1-5-10(11)13(16)17/h1-2,5-6,9H,3-4,7-8H2