3-[(6-methyl-2-morpholin-4-yl-pyrimidin-4-yl)amino]benzoic acid

Systemtic Name: 3-[(6-methyl-2-morpholin-4-yl-pyrimidin-4-yl)amino]benzoic acid Openeye Name: 3-[(6-methyl-2-morpholino-pyrimidin-4-yl)amino]benzoic acid CAS Name: 3-[[6-methyl-2-(4-morpholinyl)-4-pyrimidinyl]amino]benzoic acid IUPAC Name: 3-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)amino]benzoic acid Traditional Name: 3-[(6-methyl-2-morpholino-pyrimidin-4-yl)amino]benzoic acid Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCOCC2)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCOCC2)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C16H18N4O3/c1-11-9-14(18-13-4-2-3-12(10-13)15(21)22)19-16(17-11)20-5-7-23-8-6-20/h2-4,9-10H,5-8H2,1H3,(H,21,22)(H,17,18,19)