1-[2-(3,5-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[2-(3,5-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoyl]piperidine-2-carboxylic acid Openeye Name: 1-[2-(3,5-dimethyl-7-oxo-furo[3,2-g]chromen-6-yl)acetyl]piperidine-2-carboxylic acid CAS Name: 1-[2-(3,5-dimethyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxoethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]piperidine-2-carboxylic acid Traditional Name: 1-[2-(7-keto-3,5-dimethyl-furo[3,2-g]chromen-6-yl)acetyl]pipecolinic acid Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)N4CCCCC4C(=O)O)C

Isomeric SMILES

CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)N4CCCCC4C(=O)O)C

InChI

InChI=1S/C21H21NO6/c1-11-10-27-17-9-18-14(7-13(11)17)12(2)15(21(26)28-18)8-19(23)22-6-4-3-5-16(22)20(24)25/h7,9-10,16H,3-6,8H2,1-2H3,(H,24,25)