N-[4-[(E)-3-(4-morpholin-4-ylquinolin-2-yl)prop-2-enoyl]phenyl]pyrrolidine-1-carboxamide

Systemtic Name: N-[4-[(E)-3-(4-morpholin-4-ylquinolin-2-yl)prop-2-enoyl]phenyl]pyrrolidine-1-carboxamide Openeye Name: N-[4-[(E)-3-(4-morpholino-2-quinolyl)prop-2-enoyl]phenyl]pyrrolidine-1-carboxamide CAS Name: N-[4-[(E)-3-[4-(4-morpholinyl)-2-quinolinyl]-1-oxoprop-2-enyl]phenyl]-1-pyrrolidinecarboxamide IUPAC Name: N-[4-[(E)-3-(4-morpholin-4-ylquinolin-2-yl)prop-2-enoyl]phenyl]pyrrolidine-1-carboxamide Traditional Name: N-[4-[(E)-3-(4-morpholino-2-quinolyl)acryloyl]phenyl]pyrrolidine-1-carboxamide Formula: C27H28N4O3 MolecularWeight: 456.53622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)NC2=CC=C(C=C2)C(=O)C=CC3=NC4=CC=CC=C4C(=C3)N5CCOCC5

Isomeric SMILES

C1CCN(C1)C(=O)NC2=CC=C(C=C2)C(=O)/C=C/C3=NC4=CC=CC=C4C(=C3)N5CCOCC5

InChI

InChI=1S/C27H28N4O3/c32-26(20-7-9-21(10-8-20)29-27(33)31-13-3-4-14-31)12-11-22-19-25(30-15-17-34-18-16-30)23-5-1-2-6-24(23)28-22/h1-2,5-12,19H,3-4,13-18H2,(H,29,33)/b12-11+