(E)-4-[(3-methoxycarbonyl-4-morpholin-4-yl-phenyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3-methoxycarbonyl-4-morpholin-4-yl-phenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(3-methoxycarbonyl-4-morpholino-anilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3-methoxycarbonyl-4-(4-morpholinyl)anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(3-methoxycarbonyl-4-morpholin-4-ylanilino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(3-carbomethoxy-4-morpholino-anilino)-4-keto-but-2-enoic acid Formula: C16H18N2O6 MolecularWeight: 334.32392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)C=CC(=O)O)N2CCOCC2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)/C=C/C(=O)O)N2CCOCC2

InChI

InChI=1S/C16H18N2O6/c1-23-16(22)12-10-11(17-14(19)4-5-15(20)21)2-3-13(12)18-6-8-24-9-7-18/h2-5,10H,6-9H2,1H3,(H,17,19)(H,20,21)/b5-4+