3-[1-(1-ethylpiperidin-3-yl)ethylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-4-methyl-benzoic acid Openeye Name: 3-[1-(1-ethyl-3-piperidyl)ethylamino]-4-methyl-benzoic acid CAS Name: 3-[1-(1-ethyl-3-piperidinyl)ethylamino]-4-methylbenzoic acid IUPAC Name: 3-[1-(1-ethylpiperidin-3-yl)ethylamino]-4-methylbenzoic acid Traditional Name: 3-[1-(1-ethyl-3-piperidyl)ethylamino]-4-methyl-benzoic acid Formula: C17H26N2O2 MolecularWeight: 290.40054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)C(C)NC2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CCN1CCCC(C1)C(C)NC2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C17H26N2O2/c1-4-19-9-5-6-15(11-19)13(3)18-16-10-14(17(20)21)8-7-12(16)2/h7-8,10,13,15,18H,4-6,9,11H2,1-3H3,(H,20,21)