4-[(8-cyclopentyloxy-7-methoxy-2-oxidanylidene-chromen-4-yl)amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[(8-cyclopentyloxy-7-methoxy-2-oxidanylidene-chromen-4-yl)amino]cyclohexane-1-carboxylic acid Openeye Name: 4-[[8-(cyclopentoxy)-7-methoxy-2-oxo-chromen-4-yl]amino]cyclohexanecarboxylic acid CAS Name: 4-[(8-cyclopentyloxy-7-methoxy-2-oxo-1-benzopyran-4-yl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[(8-cyclopentyloxy-7-methoxy-2-oxochromen-4-yl)amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[[8-(cyclopentoxy)-2-keto-7-methoxy-chromen-4-yl]amino]cyclohexanecarboxylic acid Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=CC(=O)O2)NC3CCC(CC3)C(=O)O)OC4CCCC4

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=CC(=O)O2)NC3CCC(CC3)C(=O)O)OC4CCCC4

InChI

InChI=1S/C22H27NO6/c1-27-18-11-10-16-17(23-14-8-6-13(7-9-14)22(25)26)12-19(24)29-20(16)21(18)28-15-4-2-3-5-15/h10-15,23H,2-9H2,1H3,(H,25,26)