3-(3-methylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(3-methylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(3-methylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(3-methylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(3-methylphenoxy)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(3-methylphenoxy)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]propionamide Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C20H22N4O2/c1-16-3-2-4-19(11-16)26-10-9-20(25)22-12-17-5-7-18(8-6-17)13-24-15-21-14-23-24/h2-8,11,14-15H,9-10,12-13H2,1H3,(H,22,25)