2-[bis[(E)-3-quinolin-4-ylprop-2-enyl]amino]propanoic acid

Systemtic Name: 2-[bis[(E)-3-quinolin-4-ylprop-2-enyl]amino]propanoic acid Openeye Name: 2-[bis[(E)-3-(4-quinolyl)allyl]amino]propanoic acid CAS Name: 2-[bis[(E)-3-(4-quinolinyl)prop-2-enyl]amino]propanoic acid IUPAC Name: 2-[bis[(E)-3-quinolin-4-ylprop-2-enyl]amino]propanoic acid Traditional Name: 2-[bis[(E)-3-(4-quinolyl)allyl]amino]propionic acid Formula: C27H25N3O2 MolecularWeight: 423.5063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(CC=CC1=CC=NC2=CC=CC=C12)CC=CC3=CC=NC4=CC=CC=C34

Isomeric SMILES

CC(N(C/C=C/C1=CC=NC2=CC=CC=C12)C/C=C/C3=CC=NC4=CC=CC=C34)C(=O)O

InChI

InChI=1S/C27H25N3O2/c1-20(27(31)32)30(18-6-8-21-14-16-28-25-12-4-2-10-23(21)25)19-7-9-22-15-17-29-26-13-5-3-11-24(22)26/h2-17,20H,18-19H2,1H3,(H,31,32)/b8-6+,9-7+