3-methyl-4-[3-(oxolan-2-yl)propanoylamino]benzoic acid

Systemtic Name: 3-methyl-4-[3-(oxolan-2-yl)propanoylamino]benzoic acid Openeye Name: 3-methyl-4-(3-tetrahydrofuran-2-ylpropanoylamino)benzoic acid CAS Name: 3-methyl-4-[[1-oxo-3-(2-oxolanyl)propyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[3-(oxolan-2-yl)propanoylamino]benzoic acid Traditional Name: 3-methyl-4-[3-(tetrahydrofuryl)propanoylamino]benzoic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CCC2CCCO2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CCC2CCCO2

InChI

InChI=1S/C15H19NO4/c1-10-9-11(15(18)19)4-6-13(10)16-14(17)7-5-12-3-2-8-20-12/h4,6,9,12H,2-3,5,7-8H2,1H3,(H,16,17)(H,18,19)