4-[(4-methylpiperazin-1-yl)amino]benzoic acid

Systemtic Name: 4-[(4-methylpiperazin-1-yl)amino]benzoic acid Openeye Name: 4-[(4-methylpiperazin-1-yl)amino]benzoic acid CAS Name: 4-[(4-methyl-1-piperazinyl)amino]benzoic acid IUPAC Name: 4-[(4-methylpiperazin-1-yl)amino]benzoic acid Traditional Name: 4-[(4-methylpiperazino)amino]benzoic acid Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1CCN(CC1)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H17N3O2/c1-14-6-8-15(9-7-14)13-11-4-2-10(3-5-11)12(16)17/h2-5,13H,6-9H2,1H3,(H,16,17)