5-azanyl-2-(3-methylpiperazin-1-yl)benzoic acid

Systemtic Name: 5-azanyl-2-(3-methylpiperazin-1-yl)benzoic acid Openeye Name: 5-amino-2-(3-methylpiperazin-1-yl)benzoic acid CAS Name: 5-amino-2-(3-methyl-1-piperazinyl)benzoic acid IUPAC Name: 5-amino-2-(3-methylpiperazin-1-yl)benzoic acid Traditional Name: 5-amino-2-(3-methylpiperazino)benzoic acid Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=C(C=C2)N)C(=O)O

Isomeric SMILES

CC1CN(CCN1)C2=C(C=C(C=C2)N)C(=O)O

InChI

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