2-[[2,2-dimethyl-3-oxidanyl-6-(phenylcarbonyl)-3,4-dihydrochromen-4-yl]-phenyl-amino]ethanoic acid

Systemtic Name: 2-[[2,2-dimethyl-3-oxidanyl-6-(phenylcarbonyl)-3,4-dihydrochromen-4-yl]-phenyl-amino]ethanoic acid Openeye Name: 2-(N-(6-benzoyl-3-hydroxy-2,2-dimethyl-chroman-4-yl)anilino)acetic acid CAS Name: 2-(N-(6-benzoyl-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)anilino)acetic acid IUPAC Name: 2-(N-(6-benzoyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)anilino)acetic acid Traditional Name: 2-(N-(6-benzoyl-3-hydroxy-2,2-dimethyl-chroman-4-yl)anilino)acetic acid Formula: C26H25NO5 MolecularWeight: 431.4804

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3)N(CC(=O)O)C4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3)N(CC(=O)O)C4=CC=CC=C4)O)C

InChI

InChI=1S/C26H25NO5/c1-26(2)25(31)23(27(16-22(28)29)19-11-7-4-8-12-19)20-15-18(13-14-21(20)32-26)24(30)17-9-5-3-6-10-17/h3-15,23,25,31H,16H2,1-2H3,(H,28,29)