2-[4-(2-chlorophenyl)-5-oxidanylidene-1,2,3,4-tetrazol-1-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide

Systemtic Name: 2-[4-(2-chlorophenyl)-5-oxidanylidene-1,2,3,4-tetrazol-1-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide Openeye Name: 2-[4-(2-chlorophenyl)-5-oxo-tetrazol-1-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: 2-[4-(2-chlorophenyl)-5-oxo-1-tetrazolyl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide IUPAC Name: 2-[4-(2-chlorophenyl)-5-oxotetrazol-1-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-[4-(2-chlorophenyl)-5-keto-tetrazol-1-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C18H16ClN5O4 MolecularWeight: 401.80374

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CN3C(=O)N(N=N3)C4=CC=CC=C4Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CN3C(=O)N(N=N3)C4=CC=CC=C4Cl)OC1

InChI

InChI=1S/C18H16ClN5O4/c19-13-4-1-2-5-14(13)24-18(26)23(21-22-24)11-17(25)20-12-6-7-15-16(10-12)28-9-3-8-27-15/h1-2,4-7,10H,3,8-9,11H2,(H,20,25)