1,3-bis(oxidanylidene)-2-(2-oxidanyl-2-phenyl-ethyl)-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile

Systemtic Name: 1,3-bis(oxidanylidene)-2-(2-oxidanyl-2-phenyl-ethyl)-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile Openeye Name: 2-(2-hydroxy-2-phenyl-ethyl)-1,3-dioxo-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile CAS Name: 2-(2-hydroxy-2-phenylethyl)-1,3-dioxo-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile IUPAC Name: 2-(2-hydroxy-2-phenylethyl)-1,3-dioxo-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile Traditional Name: 2-(2-hydroxy-2-phenyl-ethyl)-1,3-diketo-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)N(C(=O)N2C1)CC(C3=CC=CC=C3)O)C#N

Isomeric SMILES

C1CC2=C(C(=O)N(C(=O)N2C1)CC(C3=CC=CC=C3)O)C#N

InChI

InChI=1S/C16H15N3O3/c17-9-12-13-7-4-8-18(13)16(22)19(15(12)21)10-14(20)11-5-2-1-3-6-11/h1-3,5-6,14,20H,4,7-8,10H2