methyl 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanyl-but-2-ynoate

Systemtic Name: methyl 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanyl-but-2-ynoate Openeye Name: methyl 4-hydroxy-4-indan-5-yl-but-2-ynoate CAS Name: 4-(2,3-dihydro-1H-inden-5-yl)-4-hydroxy-2-butynoic acid methyl ester IUPAC Name: methyl 4-(2,3-dihydro-1H-inden-5-yl)-4-hydroxybut-2-ynoate Traditional Name: 4-hydroxy-4-indan-5-yl-but-2-ynoic acid methyl ester Formula: C14H14O3 MolecularWeight: 230.25916

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CC(C1=CC2=C(CCC2)C=C1)O

Isomeric SMILES

COC(=O)C#CC(C1=CC2=C(CCC2)C=C1)O

InChI

InChI=1S/C14H14O3/c1-17-14(16)8-7-13(15)12-6-5-10-3-2-4-11(10)9-12/h5-6,9,13,15H,2-4H2,1H3