[2-oxidanylidene-3-[(phenylmethyl)carbamoyl]chromen-7-yl] 4-chloranylbutanoate

Systemtic Name: [2-oxidanylidene-3-[(phenylmethyl)carbamoyl]chromen-7-yl] 4-chloranylbutanoate Openeye Name: [3-(benzylcarbamoyl)-2-oxo-chromen-7-yl] 4-chlorobutanoate CAS Name: 4-chlorobutanoic acid [2-oxo-3-[oxo-[(phenylmethyl)amino]methyl]-1-benzopyran-7-yl] ester IUPAC Name: [3-(benzylcarbamoyl)-2-oxochromen-7-yl] 4-chlorobutanoate Traditional Name: 4-chlorobutyric acid [3-(benzylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C21H18ClNO5 MolecularWeight: 399.82432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClNO5/c22-10-4-7-19(24)27-16-9-8-15-11-17(21(26)28-18(15)12-16)20(25)23-13-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12H,4,7,10,13H2,(H,23,25)