4-[[[(2R)-2-(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[[(2R)-2-(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[(2R)-2-(6-chloro-2-oxo-4-propyl-chromen-7-yl)oxypropanoyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[(2R)-2-[(6-chloro-2-oxo-4-propyl-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[(2R)-2-(6-chloro-2-oxo-4-propylchromen-7-yl)oxypropanoyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[(2R)-2-(6-chloro-2-keto-4-propyl-chromen-7-yl)oxypropanoyl]amino]methyl]cyclohexanecarboxylate Formula: C23H27ClNO6- MolecularWeight: 448.91658

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(C)C(=O)NCC3CCC(CC3)C(=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)O[C@H](C)C(=O)NCC3CCC(CC3)C(=O)[O-]

InChI

InChI=1S/C23H28ClNO6/c1-3-4-16-9-21(26)31-19-11-20(18(24)10-17(16)19)30-13(2)22(27)25-12-14-5-7-15(8-6-14)23(28)29/h9-11,13-15H,3-8,12H2,1-2H3,(H,25,27)(H,28,29)/p-1/t13-,14?,15?/m1/s1