N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-1-ethyl-benzotriazole-5-carboxamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-1-ethyl-benzotriazole-5-carboxamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-1-ethyl-benzotriazole-5-carboxamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-1-ethyl-5-benzotriazolecarboxamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-1-ethylbenzotriazole-5-carboxamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-1-ethyl-benzotriazole-5-carboxamide Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC(C3=CC4=C(C=C3)OCCO4)C(C)C)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC(C3=CC4=C(C=C3)OCCO4)C(C)C)N=N1

InChI

InChI=1S/C21H24N4O3/c1-4-25-17-7-5-15(11-16(17)23-24-25)21(26)22-20(13(2)3)14-6-8-18-19(12-14)28-10-9-27-18/h5-8,11-13,20H,4,9-10H2,1-3H3,(H,22,26)