(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-[[(E)-3-phenylprop-2-enoyl]amino]propanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-[[(E)-3-phenylprop-2-enoyl]amino]propanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 3-[[(E)-3-phenylprop-2-enoyl]amino]propanoate CAS Name: 3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]propanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 3-[[(E)-3-phenylprop-2-enoyl]amino]propanoate Traditional Name: 3-[[(E)-3-phenylacryloyl]amino]propionic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C24H23NO5 MolecularWeight: 405.44312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCNC(=O)C=CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCNC(=O)/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C24H23NO5/c1-16-12-20-19(14-24(28)30-21(20)13-17(16)2)15-29-23(27)10-11-25-22(26)9-8-18-6-4-3-5-7-18/h3-9,12-14H,10-11,15H2,1-2H3,(H,25,26)/b9-8+