2-chloranyl-5-[(1-prop-2-ynylpiperidin-4-yl)amino]benzoic acid

Systemtic Name: 2-chloranyl-5-[(1-prop-2-ynylpiperidin-4-yl)amino]benzoic acid Openeye Name: 2-chloro-5-[(1-prop-2-ynyl-4-piperidyl)amino]benzoic acid CAS Name: 2-chloro-5-[(1-prop-2-ynyl-4-piperidinyl)amino]benzoic acid IUPAC Name: 2-chloro-5-[(1-prop-2-ynylpiperidin-4-yl)amino]benzoic acid Traditional Name: 2-chloro-5-[(1-propargyl-4-piperidyl)amino]benzoic acid Formula: C15H17ClN2O2 MolecularWeight: 292.76068

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCC(CC1)NC2=CC(=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C#CCN1CCC(CC1)NC2=CC(=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H17ClN2O2/c1-2-7-18-8-5-11(6-9-18)17-12-3-4-14(16)13(10-12)15(19)20/h1,3-4,10-11,17H,5-9H2,(H,19,20)