5-azanyl-2-(4-methylpiperazin-1-yl)carbonyl-benzoic acid

Systemtic Name: 5-azanyl-2-(4-methylpiperazin-1-yl)carbonyl-benzoic acid Openeye Name: 5-amino-2-(4-methylpiperazine-1-carbonyl)benzoic acid CAS Name: 5-amino-2-[(4-methyl-1-piperazinyl)-oxomethyl]benzoic acid IUPAC Name: 5-amino-2-(4-methylpiperazine-1-carbonyl)benzoic acid Traditional Name: 5-amino-2-(4-methylpiperazine-1-carbonyl)benzoic acid Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=C(C=C(C=C2)N)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=C(C=C(C=C2)N)C(=O)O

InChI

InChI=1S/C13H17N3O3/c1-15-4-6-16(7-5-15)12(17)10-3-2-9(14)8-11(10)13(18)19/h2-3,8H,4-7,14H2,1H3,(H,18,19)