N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C19H18N4O3/c24-19(18-11-25-16-3-1-2-4-17(16)26-18)21-9-14-5-7-15(8-6-14)10-23-13-20-12-22-23/h1-8,12-13,18H,9-11H2,(H,21,24)