[2-oxidanylidene-3-(1-phenylethylcarbamoyl)chromen-7-yl] 4-chloranylbutanoate

Systemtic Name: [2-oxidanylidene-3-(1-phenylethylcarbamoyl)chromen-7-yl] 4-chloranylbutanoate Openeye Name: [2-oxo-3-(1-phenylethylcarbamoyl)chromen-7-yl] 4-chlorobutanoate CAS Name: 4-chlorobutanoic acid [2-oxo-3-[oxo-(1-phenylethylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(1-phenylethylcarbamoyl)chromen-7-yl] 4-chlorobutanoate Traditional Name: 4-chlorobutyric acid [2-keto-3-(1-phenylethylcarbamoyl)chromen-7-yl] ester Formula: C22H20ClNO5 MolecularWeight: 413.8509

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C(C=C3)OC(=O)CCCCl)OC2=O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C(C=C3)OC(=O)CCCCl)OC2=O

InChI

InChI=1S/C22H20ClNO5/c1-14(15-6-3-2-4-7-15)24-21(26)18-12-16-9-10-17(13-19(16)29-22(18)27)28-20(25)8-5-11-23/h2-4,6-7,9-10,12-14H,5,8,11H2,1H3,(H,24,26)