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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3=CC=CC=C3C(=O)OC

InChI

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