2-[[3-(methylamino)propylamino]methyl]benzoic acid

Systemtic Name: 2-[[3-(methylamino)propylamino]methyl]benzoic acid Openeye Name: 2-[[3-(methylamino)propylamino]methyl]benzoic acid CAS Name: 2-[[3-(methylamino)propylamino]methyl]benzoic acid IUPAC Name: 2-[[3-(methylamino)propylamino]methyl]benzoic acid Traditional Name: 2-[[3-(methylamino)propylamino]methyl]benzoic acid Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCNCC1=CC=CC=C1C(=O)O

Isomeric SMILES

CNCCCNCC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C12H18N2O2/c1-13-7-4-8-14-9-10-5-2-3-6-11(10)12(15)16/h2-3,5-6,13-14H,4,7-9H2,1H3,(H,15,16)