3-chloranyl-5-ethoxy-4-propoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: 3-chloranyl-5-ethoxy-4-propoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Openeye Name: 3-chloro-5-ethoxy-4-propoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide CAS Name: 3-chloro-5-ethoxy-4-propoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide IUPAC Name: 3-chloro-5-ethoxy-4-propoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Traditional Name: 3-chloro-5-ethoxy-4-propoxy-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Formula: C21H23ClN4O3 MolecularWeight: 414.88532

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)CN3C=NC=N3)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)CN3C=NC=N3)OCC

InChI

InChI=1S/C21H23ClN4O3/c1-3-9-29-20-18(22)10-16(11-19(20)28-4-2)21(27)25-17-7-5-15(6-8-17)12-26-14-23-13-24-26/h5-8,10-11,13-14H,3-4,9,12H2,1-2H3,(H,25,27)