2-[[(1-ethanimidoylpiperidin-4-yl)-methyl-amino]methyl]benzoic acid

Systemtic Name: 2-[[(1-ethanimidoylpiperidin-4-yl)-methyl-amino]methyl]benzoic acid Openeye Name: 2-[[(1-ethanimidoyl-4-piperidyl)-methyl-amino]methyl]benzoic acid CAS Name: 2-[[[1-(1-iminoethyl)-4-piperidinyl]-methylamino]methyl]benzoic acid IUPAC Name: 2-[[(1-ethanimidoylpiperidin-4-yl)-methylamino]methyl]benzoic acid Traditional Name: 2-[[(1-acetimidoyl-4-piperidyl)-methyl-amino]methyl]benzoic acid Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)N(C)CC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(=N)N1CCC(CC1)N(C)CC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H23N3O2/c1-12(17)19-9-7-14(8-10-19)18(2)11-13-5-3-4-6-15(13)16(20)21/h3-6,14,17H,7-11H2,1-2H3,(H,20,21)