(2R,3R)-2-butoxy-4-oxidanylidene-3-[(E)-3-phenylprop-2-enyl]-2H-chromene-3-carbonitrile

Systemtic Name: (2R,3R)-2-butoxy-4-oxidanylidene-3-[(E)-3-phenylprop-2-enyl]-2H-chromene-3-carbonitrile Openeye Name: (2R,3R)-2-butoxy-3-[(E)-cinnamyl]-4-oxo-chromane-3-carbonitrile CAS Name: (2R,3R)-2-butoxy-4-oxo-3-[(E)-3-phenylprop-2-enyl]-3,4-dihydro-2H-1-benzopyran-3-carbonitrile IUPAC Name: (2R,3R)-2-butoxy-4-oxo-3-[(E)-3-phenylprop-2-enyl]-2H-chromene-3-carbonitrile Traditional Name: (2R,3R)-2-butoxy-3-[(E)-cinnamyl]-4-keto-chroman-3-carbonitrile Formula: C23H23NO3 MolecularWeight: 361.43362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1C(C(=O)C2=CC=CC=C2O1)(CC=CC3=CC=CC=C3)C#N

Isomeric SMILES

CCCCO[C@H]1[C@@](C(=O)C2=CC=CC=C2O1)(C/C=C/C3=CC=CC=C3)C#N

InChI

InChI=1S/C23H23NO3/c1-2-3-16-26-22-23(17-24,15-9-12-18-10-5-4-6-11-18)21(25)19-13-7-8-14-20(19)27-22/h4-14,22H,2-3,15-16H2,1H3/b12-9+/t22-,23+/m1/s1