2-[5-[3-[(5-ethylpyrimidin-2-yl)-methyl-amino]propoxy]-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-[3-[(5-ethylpyrimidin-2-yl)-methyl-amino]propoxy]-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-[3-[(5-ethylpyrimidin-2-yl)-methyl-amino]propoxy]-1H-indol-3-yl]acetic acid CAS Name: 2-[5-[3-[(5-ethyl-2-pyrimidinyl)-methylamino]propoxy]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-[3-[(5-ethylpyrimidin-2-yl)-methylamino]propoxy]-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-[3-[(5-ethylpyrimidin-2-yl)-methyl-amino]propoxy]-1H-indol-3-yl]acetic acid Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)N(C)CCCOC2=CC3=C(C=C2)NC=C3CC(=O)O

Isomeric SMILES

CCC1=CN=C(N=C1)N(C)CCCOC2=CC3=C(C=C2)NC=C3CC(=O)O

InChI

InChI=1S/C20H24N4O3/c1-3-14-11-22-20(23-12-14)24(2)7-4-8-27-16-5-6-18-17(10-16)15(13-21-18)9-19(25)26/h5-6,10-13,21H,3-4,7-9H2,1-2H3,(H,25,26)