ethyl (Z)-2-(1H-benzimidazol-2-yl)-3-(1,3-benzodioxol-5-ylmethylamino)prop-2-enoate

Systemtic Name: ethyl (Z)-2-(1H-benzimidazol-2-yl)-3-(1,3-benzodioxol-5-ylmethylamino)prop-2-enoate Openeye Name: ethyl (Z)-2-(1H-benzimidazol-2-yl)-3-(1,3-benzodioxol-5-ylmethylamino)prop-2-enoate CAS Name: (Z)-2-(1H-benzimidazol-2-yl)-3-(1,3-benzodioxol-5-ylmethylamino)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-(1H-benzimidazol-2-yl)-3-(1,3-benzodioxol-5-ylmethylamino)prop-2-enoate Traditional Name: (Z)-2-(1H-benzimidazol-2-yl)-3-(piperonylamino)acrylic acid ethyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNCC1=CC2=C(C=C1)OCO2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CCOC(=O)/C(=C\NCC1=CC2=C(C=C1)OCO2)/C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H19N3O4/c1-2-25-20(24)14(19-22-15-5-3-4-6-16(15)23-19)11-21-10-13-7-8-17-18(9-13)27-12-26-17/h3-9,11,21H,2,10,12H2,1H3,(H,22,23)/b14-11-