3-[3-(4-chloranylphenoxy)propyl]-1-ethyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 3-[3-(4-chloranylphenoxy)propyl]-1-ethyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 3-[3-(4-chlorophenoxy)propyl]-1-ethyl-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 3-[3-(4-chlorophenoxy)propyl]-1-ethyl-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 3-[3-(4-chlorophenoxy)propyl]-1-ethyl-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 3-[3-(4-chlorophenoxy)propyl]-1-ethyl-2,4-diketo-pyrimidine-5-carbonitrile Formula: C16H16ClN3O3 MolecularWeight: 333.76954

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CCCOC2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CCCOC2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C16H16ClN3O3/c1-2-19-11-12(10-18)15(21)20(16(19)22)8-3-9-23-14-6-4-13(17)5-7-14/h4-7,11H,2-3,8-9H2,1H3