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

Systemtic Name: [2-oxidanylidene-3-(1-phenylethylcarbamoyl)chromen-7-yl] 3-chloranylpropanoate Openeye Name: [2-oxo-3-(1-phenylethylcarbamoyl)chromen-7-yl] 3-chloropropanoate CAS Name: 3-chloropropanoic acid [2-oxo-3-[oxo-(1-phenylethylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(1-phenylethylcarbamoyl)chromen-7-yl] 3-chloropropanoate Traditional Name: 3-chloropropionic acid [2-keto-3-(1-phenylethylcarbamoyl)chromen-7-yl] ester Formula: C21H18ClNO5 MolecularWeight: 399.82432

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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)CCCl)OC2=O

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClNO5/c1-13(14-5-3-2-4-6-14)23-20(25)17-11-15-7-8-16(27-19(24)9-10-22)12-18(15)28-21(17)26/h2-8,11-13H,9-10H2,1H3,(H,23,25)