2-(6-chloranylbenzotriazol-1-yl)oxy-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide

Systemtic Name: 2-(6-chloranylbenzotriazol-1-yl)oxy-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide Openeye Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: 2-[(6-chloro-1-benzotriazolyl)oxy]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide IUPAC Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C17H15ClN4O4 MolecularWeight: 374.7784

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CON3C4=C(C=CC(=C4)Cl)N=N3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CON3C4=C(C=CC(=C4)Cl)N=N3)OC1

InChI

InChI=1S/C17H15ClN4O4/c18-11-2-4-13-14(8-11)22(21-20-13)26-10-17(23)19-12-3-5-15-16(9-12)25-7-1-6-24-15/h2-5,8-9H,1,6-7,10H2,(H,19,23)