(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(2-phenylethanoylamino)propanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(2-phenylethanoylamino)propanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)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-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23NO5/c1-15-10-19-18(13-23(27)29-20(19)11-16(15)2)14-28-22(26)8-9-24-21(25)12-17-6-4-3-5-7-17/h3-7,10-11,13H,8-9,12,14H2,1-2H3,(H,24,25)