N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-2-phenyl-triazole-4-carboxamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-2-phenyl-4-triazolecarboxamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-2-phenyltriazole-4-carboxamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C19H17ClN4O3 MolecularWeight: 384.81628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2=CC3=C(C=C2Cl)OCCCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2=CC3=C(C=C2Cl)OCCCO3)C4=CC=CC=C4

InChI

InChI=1S/C19H17ClN4O3/c1-12-18(23-24(22-12)13-6-3-2-4-7-13)19(25)21-15-11-17-16(10-14(15)20)26-8-5-9-27-17/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,21,25)