N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-ethyl-benzotriazole-5-carboxamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-ethyl-benzotriazole-5-carboxamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-ethyl-benzotriazole-5-carboxamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-ethyl-5-benzotriazolecarboxamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-ethylbenzotriazole-5-carboxamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-ethyl-benzotriazole-5-carboxamide Formula: C18H17ClN4O3 MolecularWeight: 372.80558

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3Cl)OCCCO4)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3Cl)OCCCO4)N=N1

InChI

InChI=1S/C18H17ClN4O3/c1-2-23-15-5-4-11(8-14(15)21-22-23)18(24)20-13-10-17-16(9-12(13)19)25-6-3-7-26-17/h4-5,8-10H,2-3,6-7H2,1H3,(H,20,24)