4-(1,3-benzoxazol-2-yl)-3-(2-hydroxyphenyl)-4-(phenylcarbonyl)cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: 4-(1,3-benzoxazol-2-yl)-3-(2-hydroxyphenyl)-4-(phenylcarbonyl)cyclohexa-2,5-diene-1-carboxylate Openeye Name: 4-(1,3-benzoxazol-2-yl)-4-benzoyl-3-(2-hydroxyphenyl)cyclohexa-2,5-diene-1-carboxylate CAS Name: 4-(1,3-benzoxazol-2-yl)-4-benzoyl-3-(2-hydroxyphenyl)-1-cyclohexa-2,5-dienecarboxylate IUPAC Name: 4-(1,3-benzoxazol-2-yl)-4-benzoyl-3-(2-hydroxyphenyl)cyclohexa-2,5-diene-1-carboxylate Traditional Name: 4-(1,3-benzoxazol-2-yl)-4-benzoyl-3-(2-hydroxyphenyl)cyclohexa-2,5-diene-1-carboxylate Formula: C27H18NO5- MolecularWeight: 436.43552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2(C=CC(C=C2C3=CC=CC=C3O)C(=O)[O-])C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2(C=CC(C=C2C3=CC=CC=C3O)C(=O)[O-])C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C27H19NO5/c29-22-12-6-4-10-19(22)20-16-18(25(31)32)14-15-27(20,24(30)17-8-2-1-3-9-17)26-28-21-11-5-7-13-23(21)33-26/h1-16,18,29H,(H,31,32)/p-1