2-[[6-cyclopropyl-4-oxidanylidene-2-phenyl-5-(phenylmethyl)pyran-3-yl]carbonylamino]benzoic acid

Systemtic Name: 2-[[6-cyclopropyl-4-oxidanylidene-2-phenyl-5-(phenylmethyl)pyran-3-yl]carbonylamino]benzoic acid Openeye Name: 2-[(5-benzyl-6-cyclopropyl-4-oxo-2-phenyl-pyran-3-carbonyl)amino]benzoic acid CAS Name: 2-[[[6-cyclopropyl-4-oxo-2-phenyl-5-(phenylmethyl)-3-pyranyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[(5-benzyl-6-cyclopropyl-4-oxo-2-phenylpyran-3-carbonyl)amino]benzoic acid Traditional Name: 2-[(5-benzyl-6-cyclopropyl-4-keto-2-phenyl-pyran-3-carbonyl)amino]benzoic acid Formula: C29H23NO5 MolecularWeight: 465.49662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=O)C(=C(O2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(=O)O)CC5=CC=CC=C5

Isomeric SMILES

C1CC1C2=C(C(=O)C(=C(O2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(=O)O)CC5=CC=CC=C5

InChI

InChI=1S/C29H23NO5/c31-25-22(17-18-9-3-1-4-10-18)26(20-15-16-20)35-27(19-11-5-2-6-12-19)24(25)28(32)30-23-14-8-7-13-21(23)29(33)34/h1-14,20H,15-17H2,(H,30,32)(H,33,34)