2-[(4-methoxyphenyl)-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]amino]ethanoic acid

Systemtic Name: 2-[(4-methoxyphenyl)-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]amino]ethanoic acid Openeye Name: 2-(4-methoxy-N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]anilino)acetic acid CAS Name: 2-(4-methoxy-N-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]anilino)acetic acid IUPAC Name: 2-(4-methoxy-N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]anilino)acetic acid Traditional Name: 2-(N-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]-4-methoxy-anilino)acetic acid Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C3=NC=CC=N3)CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C3=NC=CC=N3)CC(=O)O

InChI

InChI=1S/C19H23N5O4/c1-28-16-5-3-15(4-6-16)24(14-18(26)27)13-17(25)22-9-11-23(12-10-22)19-20-7-2-8-21-19/h2-8H,9-14H2,1H3,(H,26,27)