(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-[(4-chlorophenyl)carbonylamino]propanoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 3-[(4-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 3-[(4-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(4-chlorobenzoyl)amino]propionic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C22H20ClNO5 MolecularWeight: 413.8509

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H20ClNO5/c1-2-14-3-8-18-16(12-21(26)29-19(18)11-14)13-28-20(25)9-10-24-22(27)15-4-6-17(23)7-5-15/h3-8,11-12H,2,9-10,13H2,1H3,(H,24,27)