(E)-3-ethoxycarbonyl-2-oxidanylidene-4-phenyl-4-(2-phenyl-1H-indol-3-yl)but-3-enoic acid

Systemtic Name: (E)-3-ethoxycarbonyl-2-oxidanylidene-4-phenyl-4-(2-phenyl-1H-indol-3-yl)but-3-enoic acid Openeye Name: (E)-3-ethoxycarbonyl-2-oxo-4-phenyl-4-(2-phenyl-1H-indol-3-yl)but-3-enoic acid CAS Name: (E)-3-ethoxycarbonyl-2-oxo-4-phenyl-4-(2-phenyl-1H-indol-3-yl)-3-butenoic acid IUPAC Name: (E)-3-ethoxycarbonyl-2-oxo-4-phenyl-4-(2-phenyl-1H-indol-3-yl)but-3-enoic acid Traditional Name: (E)-3-carbethoxy-2-keto-4-phenyl-4-(2-phenyl-1H-indol-3-yl)but-3-enoic acid Formula: C27H21NO5 MolecularWeight: 439.45934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C1=CC=CC=C1)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C(=O)C(=O)O

Isomeric SMILES

CCOC(=O)/C(=C(\C1=CC=CC=C1)/C2=C(NC3=CC=CC=C32)C4=CC=CC=C4)/C(=O)C(=O)O

InChI

InChI=1S/C27H21NO5/c1-2-33-27(32)23(25(29)26(30)31)21(17-11-5-3-6-12-17)22-19-15-9-10-16-20(19)28-24(22)18-13-7-4-8-14-18/h3-16,28H,2H2,1H3,(H,30,31)/b23-21+