(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(4-chlorophenyl)carbonylamino]butanoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(4-chlorophenyl)carbonylamino]butanoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 4-[(4-chlorobenzoyl)amino]butanoate CAS Name: 4-[[(4-chlorophenyl)-oxomethyl]amino]butanoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 4-[(4-chlorobenzoyl)amino]butanoate Traditional Name: 4-[(4-chlorobenzoyl)amino]butyric acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C21H17BrClNO5 MolecularWeight: 478.72038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)Cl

InChI

InChI=1S/C21H17BrClNO5/c22-15-5-8-17-14(10-20(26)29-18(17)11-15)12-28-19(25)2-1-9-24-21(27)13-3-6-16(23)7-4-13/h3-8,10-11H,1-2,9,12H2,(H,24,27)