4-[(E)-3-[(3S)-6-methyl-2,4-bis(oxidanylidene)pyran-3-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-[(3S)-6-methyl-2,4-bis(oxidanylidene)pyran-3-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-[(3S)-6-methyl-2,4-dioxo-pyran-3-yl]-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-[(3S)-6-methyl-2,4-dioxo-3-pyranyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-[(3S)-6-methyl-2,4-dioxopyran-3-yl]-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-[(3S)-2,4-diketo-6-methyl-pyran-3-yl]-3-keto-prop-1-enyl]benzonitrile Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)C=CC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC(=O)[C@@H](C(=O)O1)C(=O)/C=C/C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H11NO4/c1-10-8-14(19)15(16(20)21-10)13(18)7-6-11-2-4-12(9-17)5-3-11/h2-8,15H,1H3/b7-6+/t15-/m0/s1