(2R,3R)-4-oxidanylidene-2-(3-phenylprop-2-ynoxy)-3-prop-2-enyl-2H-chromene-3-carbonitrile

Systemtic Name: (2R,3R)-4-oxidanylidene-2-(3-phenylprop-2-ynoxy)-3-prop-2-enyl-2H-chromene-3-carbonitrile Openeye Name: (2R,3R)-3-allyl-4-oxo-2-(3-phenylprop-2-ynoxy)chromane-3-carbonitrile CAS Name: (2R,3R)-4-oxo-2-(3-phenylprop-2-ynoxy)-3-prop-2-enyl-3,4-dihydro-2H-1-benzopyran-3-carbonitrile IUPAC Name: (2R,3R)-4-oxo-2-(3-phenylprop-2-ynoxy)-3-prop-2-enyl-2H-chromene-3-carbonitrile Traditional Name: (2R,3R)-3-allyl-4-keto-2-(3-phenylprop-2-ynoxy)chroman-3-carbonitrile Formula: C22H17NO3 MolecularWeight: 343.37528

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(C(OC2=CC=CC=C2C1=O)OCC#CC3=CC=CC=C3)C#N

Isomeric SMILES

C=CC[C@]1([C@@H](OC2=CC=CC=C2C1=O)OCC#CC3=CC=CC=C3)C#N

InChI

InChI=1S/C22H17NO3/c1-2-14-22(16-23)20(24)18-12-6-7-13-19(18)26-21(22)25-15-8-11-17-9-4-3-5-10-17/h2-7,9-10,12-13,21H,1,14-15H2/t21-,22+/m1/s1