4-[(6-ethenyl-1,3-dimethyl-2-oxidanylidene-5-phenyl-pyrimidin-3-ium-4-yl)amino]butanenitrile

Systemtic Name: 4-[(6-ethenyl-1,3-dimethyl-2-oxidanylidene-5-phenyl-pyrimidin-3-ium-4-yl)amino]butanenitrile Openeye Name: 4-[(1,3-dimethyl-2-oxo-5-phenyl-6-vinyl-pyrimidin-3-ium-4-yl)amino]butanenitrile CAS Name: 4-[(6-ethenyl-1,3-dimethyl-2-oxo-5-phenyl-4-pyrimidin-3-iumyl)amino]butanenitrile IUPAC Name: 4-[(6-ethenyl-1,3-dimethyl-2-oxo-5-phenylpyrimidin-3-ium-4-yl)amino]butanenitrile Traditional Name: 4-[(2-keto-1,3-dimethyl-5-phenyl-6-vinyl-pyrimidin-3-ium-4-yl)amino]butyronitrile Formula: C18H21N4O+ MolecularWeight: 309.38554

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=[N+](C1=O)C)NCCCC#N)C2=CC=CC=C2)C=C

Isomeric SMILES

CN1C(=C(C(=[N+](C1=O)C)NCCCC#N)C2=CC=CC=C2)C=C

InChI

InChI=1S/C18H20N4O/c1-4-15-16(14-10-6-5-7-11-14)17(20-13-9-8-12-19)22(3)18(23)21(15)2/h4-7,10-11H,1,8-9,13H2,2-3H3/p+1