1-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]naphthalene-2-carboxylic acid

Systemtic Name: 1-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]naphthalene-2-carboxylic acid Openeye Name: 1-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]naphthalene-2-carboxylic acid CAS Name: 1-[3-[butyl-(5-ethyl-2-pyrimidinyl)amino]propoxy]-2-naphthalenecarboxylic acid IUPAC Name: 1-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]naphthalene-2-carboxylic acid Traditional Name: 1-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]-2-naphthoic acid Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCOC1=C(C=CC2=CC=CC=C21)C(=O)O)C3=NC=C(C=N3)CC

Isomeric SMILES

CCCCN(CCCOC1=C(C=CC2=CC=CC=C21)C(=O)O)C3=NC=C(C=N3)CC

InChI

InChI=1S/C24H29N3O3/c1-3-5-13-27(24-25-16-18(4-2)17-26-24)14-8-15-30-22-20-10-7-6-9-19(20)11-12-21(22)23(28)29/h6-7,9-12,16-17H,3-5,8,13-15H2,1-2H3,(H,28,29)