3-[[4-[(2,2-dimethyl-7-oxidanyl-1-oxidanylidene-3H-inden-4-yl)oxy]-3,5-dimethyl-phenyl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[4-[(2,2-dimethyl-7-oxidanyl-1-oxidanylidene-3H-inden-4-yl)oxy]-3,5-dimethyl-phenyl]amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[4-(7-hydroxy-2,2-dimethyl-1-oxo-indan-4-yl)oxy-3,5-dimethyl-anilino]-3-oxo-propanoic acid CAS Name: 3-[4-[(7-hydroxy-2,2-dimethyl-1-oxo-3H-inden-4-yl)oxy]-3,5-dimethylanilino]-3-oxopropanoic acid IUPAC Name: 3-[4-[(7-hydroxy-2,2-dimethyl-1-oxo-3H-inden-4-yl)oxy]-3,5-dimethylanilino]-3-oxopropanoic acid Traditional Name: 3-[4-(7-hydroxy-1-keto-2,2-dimethyl-indan-4-yl)oxy-3,5-dimethyl-anilino]-3-keto-propionic acid Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=C3CC(C(=O)C3=C(C=C2)O)(C)C)C)NC(=O)CC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=C3CC(C(=O)C3=C(C=C2)O)(C)C)C)NC(=O)CC(=O)O

InChI

InChI=1S/C22H23NO6/c1-11-7-13(23-17(25)9-18(26)27)8-12(2)20(11)29-16-6-5-15(24)19-14(16)10-22(3,4)21(19)28/h5-8,24H,9-10H2,1-4H3,(H,23,25)(H,26,27)