(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(2-phenylethanoylamino)propanoate

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(2-phenylethanoylamino)propanoate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)amino]propanoic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl 3-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C23H22ClNO5 MolecularWeight: 427.87748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCNC(=O)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCNC(=O)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C23H22ClNO5/c1-2-16-11-20-18(13-19(16)24)17(12-23(28)30-20)14-29-22(27)8-9-25-21(26)10-15-6-4-3-5-7-15/h3-7,11-13H,2,8-10,14H2,1H3,(H,25,26)