3-acetamido-4-(4-methylpiperazin-1-yl)benzoic acid

Systemtic Name: 3-acetamido-4-(4-methylpiperazin-1-yl)benzoic acid Openeye Name: 3-acetamido-4-(4-methylpiperazin-1-yl)benzoic acid CAS Name: 3-acetamido-4-(4-methyl-1-piperazinyl)benzoic acid IUPAC Name: 3-acetamido-4-(4-methylpiperazin-1-yl)benzoic acid Traditional Name: 3-acetamido-4-(4-methylpiperazino)benzoic acid Formula: C14H19N3O3 MolecularWeight: 277.31896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)O)N2CCN(CC2)C

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)O)N2CCN(CC2)C

InChI

InChI=1S/C14H19N3O3/c1-10(18)15-12-9-11(14(19)20)3-4-13(12)17-7-5-16(2)6-8-17/h3-4,9H,5-8H2,1-2H3,(H,15,18)(H,19,20)