4-[(1,1,3,3-tetramethyl-2-oxidanylidene-inden-5-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(1,1,3,3-tetramethyl-2-oxidanylidene-inden-5-yl)carbonylamino]benzoic acid Openeye Name: 4-[(1,1,3,3-tetramethyl-2-oxo-indane-5-carbonyl)amino]benzoic acid CAS Name: 4-[[oxo-(1,1,3,3-tetramethyl-2-oxo-5-indenyl)methyl]amino]benzoic acid IUPAC Name: 4-[(1,1,3,3-tetramethyl-2-oxoindene-5-carbonyl)amino]benzoic acid Traditional Name: 4-[(2-keto-1,1,3,3-tetramethyl-indane-5-carbonyl)amino]benzoic acid Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)C(C1=O)(C)C)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)C(C1=O)(C)C)C

InChI

InChI=1S/C21H21NO4/c1-20(2)15-10-7-13(11-16(15)21(3,4)19(20)26)17(23)22-14-8-5-12(6-9-14)18(24)25/h5-11H,1-4H3,(H,22,23)(H,24,25)