4-azanyl-5-chloranyl-2-hex-1-yn-3-yloxy-benzoic acid

Systemtic Name: 4-azanyl-5-chloranyl-2-hex-1-yn-3-yloxy-benzoic acid Openeye Name: 4-amino-5-chloro-2-(1-ethynylbutoxy)benzoic acid CAS Name: 4-amino-5-chloro-2-hex-1-yn-3-yloxybenzoic acid IUPAC Name: 4-amino-5-chloro-2-hex-1-yn-3-yloxybenzoic acid Traditional Name: 4-amino-5-chloro-2-(1-propylprop-2-ynoxy)benzoic acid Formula: C13H14ClNO3 MolecularWeight: 267.70816

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#C)OC1=CC(=C(C=C1C(=O)O)Cl)N

Isomeric SMILES

CCCC(C#C)OC1=CC(=C(C=C1C(=O)O)Cl)N

InChI

InChI=1S/C13H14ClNO3/c1-3-5-8(4-2)18-12-7-11(15)10(14)6-9(12)13(16)17/h2,6-8H,3,5,15H2,1H3,(H,16,17)