N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-4-(1,2,4-triazol-1-yl)benzamide Formula: C18H15ClN4O3 MolecularWeight: 370.7897

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)NC(=O)C3=CC=C(C=C3)N4C=NC=N4)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)NC(=O)C3=CC=C(C=C3)N4C=NC=N4)Cl)OC1

InChI

InChI=1S/C18H15ClN4O3/c19-14-8-16-17(26-7-1-6-25-16)9-15(14)22-18(24)12-2-4-13(5-3-12)23-11-20-10-21-23/h2-5,8-11H,1,6-7H2,(H,22,24)