N-[4-[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]propanamide

Systemtic Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]propanamide Openeye Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-isopropoxy-1,2,4-triazol-1-yl]phenyl]propanamide CAS Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]propanamide IUPAC Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]propanamide Traditional Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-isopropoxy-1,2,4-triazol-1-yl]phenyl]propionamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)N2C(=NC(=N2)OC(C)C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)N2C(=NC(=N2)OC(C)C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N4O4/c1-4-19(26)22-15-6-8-16(9-7-15)25-20(23-21(24-25)29-13(2)3)14-5-10-17-18(11-14)28-12-27-17/h5-11,13H,4,12H2,1-3H3,(H,22,26)