3-(1,3-benzodioxol-5-yl)-N-[4-(imidazol-1-ylmethyl)phenyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(imidazol-1-ylmethyl)phenyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(imidazol-1-ylmethyl)phenyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(1-imidazolylmethyl)phenyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(imidazol-1-ylmethyl)phenyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(imidazol-1-ylmethyl)phenyl]propionamide Formula: C20H19N3O3 MolecularWeight: 349.38316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NC3=CC=C(C=C3)CN4C=CN=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)NC3=CC=C(C=C3)CN4C=CN=C4

InChI

InChI=1S/C20H19N3O3/c24-20(8-4-15-3-7-18-19(11-15)26-14-25-18)22-17-5-1-16(2-6-17)12-23-10-9-21-13-23/h1-3,5-7,9-11,13H,4,8,12,14H2,(H,22,24)