ethyl 3-[3-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]benzoate

Systemtic Name: ethyl 3-[3-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]benzoate Openeye Name: ethyl 3-[3-(7-hydroxy-4-methyl-2-oxo-chromen-3-yl)propanoylamino]benzoate CAS Name: 3-[[3-(7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-(7-hydroxy-4-methyl-2-oxochromen-3-yl)propanoylamino]benzoate Traditional Name: 3-[3-(7-hydroxy-2-keto-4-methyl-chromen-3-yl)propanoylamino]benzoic acid ethyl ester Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCC2=C(C3=C(C=C(C=C3)O)OC2=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCC2=C(C3=C(C=C(C=C3)O)OC2=O)C

InChI

InChI=1S/C22H21NO6/c1-3-28-21(26)14-5-4-6-15(11-14)23-20(25)10-9-18-13(2)17-8-7-16(24)12-19(17)29-22(18)27/h4-8,11-12,24H,3,9-10H2,1-2H3,(H,23,25)