3-chloranyl-N'-(3-chloranylpropylsulfonyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide

Systemtic Name: 3-chloranyl-N'-(3-chloranylpropylsulfonyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Openeye Name: 3-chloro-N'-(3-chloropropylsulfonyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide CAS Name: 3-chloro-N'-(3-chloropropylsulfonyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide IUPAC Name: 3-chloro-N'-(3-chloropropylsulfonyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Traditional Name: 3-chloro-N'-(3-chloropropylsulfonyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Formula: C17H17Cl2N3O4S MolecularWeight: 430.30558

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C(N1C(=O)NNS(=O)(=O)CCCCl)C=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2OC3=C(N1C(=O)NNS(=O)(=O)CCCCl)C=C(C=C3)Cl

InChI

InChI=1S/C17H17Cl2N3O4S/c18-8-3-9-27(24,25)21-20-17(23)22-11-12-4-1-2-5-15(12)26-16-7-6-13(19)10-14(16)22/h1-2,4-7,10,21H,3,8-9,11H2,(H,20,23)