(E)-N-[4-[(3-bromophenyl)amino]-7-ethoxy-quinolin-6-yl]-4-morpholin-4-yl-but-2-enamide

Systemtic Name: (E)-N-[4-[(3-bromophenyl)amino]-7-ethoxy-quinolin-6-yl]-4-morpholin-4-yl-but-2-enamide Openeye Name: (E)-N-[4-(3-bromoanilino)-7-ethoxy-6-quinolyl]-4-morpholino-but-2-enamide CAS Name: (E)-N-[4-(3-bromoanilino)-7-ethoxy-6-quinolinyl]-4-(4-morpholinyl)-2-butenamide IUPAC Name: (E)-N-[4-(3-bromoanilino)-7-ethoxyquinolin-6-yl]-4-morpholin-4-ylbut-2-enamide Traditional Name: (E)-N-[4-(3-bromoanilino)-7-ethoxy-6-quinolyl]-4-morpholino-but-2-enamide Formula: C25H27BrN4O3 MolecularWeight: 511.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=NC=CC(=C2C=C1NC(=O)C=CCN3CCOCC3)NC4=CC(=CC=C4)Br

Isomeric SMILES

CCOC1=CC2=NC=CC(=C2C=C1NC(=O)/C=C/CN3CCOCC3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C25H27BrN4O3/c1-2-33-24-17-22-20(21(8-9-27-22)28-19-6-3-5-18(26)15-19)16-23(24)29-25(31)7-4-10-30-11-13-32-14-12-30/h3-9,15-17H,2,10-14H2,1H3,(H,27,28)(H,29,31)/b7-4+