1-ethyl-2,4-bis(oxidanylidene)-3-(2-oxidanyl-3-phenoxy-propyl)pyrimidine-5-carbonitrile

Systemtic Name: 1-ethyl-2,4-bis(oxidanylidene)-3-(2-oxidanyl-3-phenoxy-propyl)pyrimidine-5-carbonitrile Openeye Name: 1-ethyl-3-(2-hydroxy-3-phenoxy-propyl)-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 1-ethyl-3-(2-hydroxy-3-phenoxypropyl)-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 1-ethyl-3-(2-hydroxy-3-phenoxypropyl)-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 1-ethyl-3-(2-hydroxy-3-phenoxy-propyl)-2,4-diketo-pyrimidine-5-carbonitrile Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CC(COC2=CC=CC=C2)O)C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CC(COC2=CC=CC=C2)O)C#N

InChI

InChI=1S/C16H17N3O4/c1-2-18-9-12(8-17)15(21)19(16(18)22)10-13(20)11-23-14-6-4-3-5-7-14/h3-7,9,13,20H,2,10-11H2,1H3