2-azanyl-3-[2-(4-methylpiperazin-1-yl)sulfonylphenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(4-methylpiperazin-1-yl)sulfonylphenyl]propanoic acid Openeye Name: 2-amino-3-[2-(4-methylpiperazin-1-yl)sulfonylphenyl]propanoic acid CAS Name: 2-amino-3-[2-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]propanoic acid IUPAC Name: 2-amino-3-[2-(4-methylpiperazin-1-yl)sulfonylphenyl]propanoic acid Traditional Name: 2-amino-3-[2-(4-methylpiperazino)sulfonylphenyl]propionic acid Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CC(C(=O)O)N

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CC(C(=O)O)N

InChI

InChI=1S/C14H21N3O4S/c1-16-6-8-17(9-7-16)22(20,21)13-5-3-2-4-11(13)10-12(15)14(18)19/h2-5,12H,6-10,15H2,1H3,(H,18,19)