(E)-4-[[6-(4-chlorophenyl)-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinolin-2-yl]oxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[6-(4-chlorophenyl)-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinolin-2-yl]oxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[6-(4-chlorophenyl)-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinolin-2-yl]oxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[6-(4-chlorophenyl)-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinolin-2-yl]oxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[6-(4-chlorophenyl)-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinolin-2-yl]oxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[6-(4-chlorophenyl)-2,3,5,6-tetrahydroimidaz[2,1-a]isoquinolin-2-yl]oxy]-4-keto-but-2-enoic acid Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2C3=NC(CN31)OC(=O)C=CC(=O)O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1C(C2=CC=CC=C2C3=NC(CN31)OC(=O)/C=C/C(=O)O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN2O4/c22-14-7-5-13(6-8-14)17-11-24-12-18(28-20(27)10-9-19(25)26)23-21(24)16-4-2-1-3-15(16)17/h1-10,17-18H,11-12H2,(H,25,26)/b10-9+