N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-phenyl-triazole-4-carboxamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-phenyltriazole-4-carboxamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-phenyl-triazole-4-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3/c1-14(2)20(15-8-9-18-19(12-15)28-11-10-27-18)23-21(26)17-13-22-25(24-17)16-6-4-3-5-7-16/h3-9,12-14,20H,10-11H2,1-2H3,(H,23,26)