2-(4-butoxyphenyl)-4-chloranyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-(4-butoxyphenyl)-4-chloranyl-pyrimidine-5-carbonitrile Openeye Name: 2-(4-butoxyphenyl)-4-chloro-pyrimidine-5-carbonitrile CAS Name: 2-(4-butoxyphenyl)-4-chloro-5-pyrimidinecarbonitrile IUPAC Name: 2-(4-butoxyphenyl)-4-chloropyrimidine-5-carbonitrile Traditional Name: 2-(4-butoxyphenyl)-4-chloro-pyrimidine-5-carbonitrile Formula: C15H14ClN3O MolecularWeight: 287.74416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC=C(C(=N2)Cl)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC=C(C(=N2)Cl)C#N

InChI

InChI=1S/C15H14ClN3O/c1-2-3-8-20-13-6-4-11(5-7-13)15-18-10-12(9-17)14(16)19-15/h4-7,10H,2-3,8H2,1H3