(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 4-(4-acetylpiperazin-1-yl)-4-oxo-butanoate CAS Name: 4-(4-acetyl-1-piperazinyl)-4-oxobutanoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 4-(4-acetylpiperazin-1-yl)-4-oxobutanoate Traditional Name: 4-(4-acetylpiperazino)-4-keto-butyric acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C22H26N2O6/c1-3-16-4-5-18-17(13-22(28)30-19(18)12-16)14-29-21(27)7-6-20(26)24-10-8-23(9-11-24)15(2)25/h4-5,12-13H,3,6-11,14H2,1-2H3