1-[2-(3-tert-butyl-4,9-dimethyl-7-oxidanylidene-furo[2,3-f]chromen-8-yl)ethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(3-tert-butyl-4,9-dimethyl-7-oxidanylidene-furo[2,3-f]chromen-8-yl)ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(3-tert-butyl-4,9-dimethyl-7-oxo-furo[2,3-f]chromen-8-yl)acetyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(3-tert-butyl-4,9-dimethyl-7-oxo-8-furo[2,3-f][1]benzopyranyl)-1-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-tert-butyl-4,9-dimethyl-7-oxofuro[2,3-f]chromen-8-yl)acetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(3-tert-butyl-7-keto-4,9-dimethyl-furo[2,3-f]chromen-8-yl)acetyl]isonipecotic acid Formula: C25H29NO6 MolecularWeight: 439.50086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCC(CC3)C(=O)O)C)C4=C1C(=CO4)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCC(CC3)C(=O)O)C)C4=C1C(=CO4)C(C)(C)C

InChI

InChI=1S/C25H29NO6/c1-13-10-18-21(22-20(13)17(12-31-22)25(3,4)5)14(2)16(24(30)32-18)11-19(27)26-8-6-15(7-9-26)23(28)29/h10,12,15H,6-9,11H2,1-5H3,(H,28,29)