[2-(butylamino)-2-oxidanylidene-ethyl] 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-butanoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-butanoate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-keto-butyric acid [2-(butylamino)-2-keto-ethyl] ester Formula: C18H23NO6 MolecularWeight: 349.37832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)CCC(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCCCNC(=O)COC(=O)CCC(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C18H23NO6/c1-2-3-8-19-17(21)12-25-18(22)7-5-14(20)13-4-6-15-16(11-13)24-10-9-23-15/h4,6,11H,2-3,5,7-10,12H2,1H3,(H,19,21)