3-[[[3-azanyl-5-methoxy-2,5-bis(oxidanylidene)pentyl]amino]methyl]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[[[3-azanyl-5-methoxy-2,5-bis(oxidanylidene)pentyl]amino]methyl]-4-fluoranyl-benzoic acid Openeye Name: 3-[[(3-amino-5-methoxy-2,5-dioxo-pentyl)amino]methyl]-4-fluoro-benzoic acid CAS Name: 3-[[(3-amino-5-methoxy-2,5-dioxopentyl)amino]methyl]-4-fluorobenzoic acid IUPAC Name: 3-[[(3-amino-5-methoxy-2,5-dioxopentyl)amino]methyl]-4-fluorobenzoic acid Traditional Name: 3-[[(3-amino-2,5-diketo-5-methoxy-pentyl)amino]methyl]-4-fluoro-benzoic acid Formula: C14H17FN2O5 MolecularWeight: 312.293583

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)CNCC1=C(C=CC(=C1)C(=O)O)F)N

Isomeric SMILES

COC(=O)CC(C(=O)CNCC1=C(C=CC(=C1)C(=O)O)F)N

InChI

InChI=1S/C14H17FN2O5/c1-22-13(19)5-11(16)12(18)7-17-6-9-4-8(14(20)21)2-3-10(9)15/h2-4,11,17H,5-7,16H2,1H3,(H,20,21)