3-[3-[(5-ethylpyrimidin-2-yl)-methyl-amino]propoxy]quinoxaline-2-carboxylic acid

Systemtic Name: 3-[3-[(5-ethylpyrimidin-2-yl)-methyl-amino]propoxy]quinoxaline-2-carboxylic acid Openeye Name: 3-[3-[(5-ethylpyrimidin-2-yl)-methyl-amino]propoxy]quinoxaline-2-carboxylic acid CAS Name: 3-[3-[(5-ethyl-2-pyrimidinyl)-methylamino]propoxy]-2-quinoxalinecarboxylic acid IUPAC Name: 3-[3-[(5-ethylpyrimidin-2-yl)-methylamino]propoxy]quinoxaline-2-carboxylic acid Traditional Name: 3-[3-[(5-ethylpyrimidin-2-yl)-methyl-amino]propoxy]quinoxaline-2-carboxylic acid Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)N(C)CCCOC2=NC3=CC=CC=C3N=C2C(=O)O

Isomeric SMILES

CCC1=CN=C(N=C1)N(C)CCCOC2=NC3=CC=CC=C3N=C2C(=O)O

InChI

InChI=1S/C19H21N5O3/c1-3-13-11-20-19(21-12-13)24(2)9-6-10-27-17-16(18(25)26)22-14-7-4-5-8-15(14)23-17/h4-5,7-8,11-12H,3,6,9-10H2,1-2H3,(H,25,26)