3-[[2-(furan-2-yl)quinazolin-4-yl]-phenethyl-amino]propanoate

Systemtic Name: 3-[[2-(furan-2-yl)quinazolin-4-yl]-phenethyl-amino]propanoate Openeye Name: 3-[[2-(2-furyl)quinazolin-4-yl]-phenethyl-amino]propanoate CAS Name: 3-[[2-(2-furanyl)-4-quinazolinyl]-phenethylamino]propanoate IUPAC Name: 3-[[2-(furan-2-yl)quinazolin-4-yl]-phenethylamino]propanoate Traditional Name: 3-[[2-(2-furyl)quinazolin-4-yl]-phenethyl-amino]propionate Formula: C23H20N3O3- MolecularWeight: 386.4232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CCC(=O)[O-])C2=NC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CCN(CCC(=O)[O-])C2=NC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C23H21N3O3/c27-21(28)13-15-26(14-12-17-7-2-1-3-8-17)23-18-9-4-5-10-19(18)24-22(25-23)20-11-6-16-29-20/h1-11,16H,12-15H2,(H,27,28)/p-1