5-[[(4R)-3-methyl-4,5,6,7-tetrahydro-1-benzofuran-4-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[(4R)-3-methyl-4,5,6,7-tetrahydro-1-benzofuran-4-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[(4R)-3-methyl-4,5,6,7-tetrahydrobenzofuran-4-yl]amino]-5-oxo-pentanoate CAS Name: 5-[[(4R)-3-methyl-4,5,6,7-tetrahydrobenzofuran-4-yl]amino]-5-oxopentanoate IUPAC Name: 5-[[(4R)-3-methyl-4,5,6,7-tetrahydro-1-benzofuran-4-yl]amino]-5-oxopentanoate Traditional Name: 5-keto-5-[[(4R)-3-methyl-4,5,6,7-tetrahydrobenzofuran-4-yl]amino]valerate Formula: C14H18NO4- MolecularWeight: 264.29702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C1C(CCC2)NC(=O)CCCC(=O)[O-]

Isomeric SMILES

CC1=COC2=C1[C@@H](CCC2)NC(=O)CCCC(=O)[O-]

InChI

InChI=1S/C14H19NO4/c1-9-8-19-11-5-2-4-10(14(9)11)15-12(16)6-3-7-13(17)18/h8,10H,2-7H2,1H3,(H,15,16)(H,17,18)/p-1/t10-/m1/s1