2-[methyl-[4-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]phenyl]amino]ethanoic acid

Systemtic Name: 2-[methyl-[4-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]phenyl]amino]ethanoic acid Openeye Name: 2-[N-methyl-4-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]anilino]acetic acid CAS Name: 2-[N-methyl-4-[[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]amino]anilino]acetic acid IUPAC Name: 2-[N-methyl-4-[(4-pyridin-4-ylpiperazine-1-carbonyl)amino]anilino]acetic acid Traditional Name: 2-[N-methyl-4-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]anilino]acetic acid Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CN(CC(=O)O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C19H23N5O3/c1-22(14-18(25)26)16-4-2-15(3-5-16)21-19(27)24-12-10-23(11-13-24)17-6-8-20-9-7-17/h2-9H,10-14H2,1H3,(H,21,27)(H,25,26)