[3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoate

Systemtic Name: [3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoate Openeye Name: [3-(butylcarbamoyl)-2-oxo-chromen-7-yl] 6-(1,3-dioxoisoindolin-2-yl)hexanoate CAS Name: 6-(1,3-dioxo-2-isoindolyl)hexanoic acid [3-[butylamino(oxo)methyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(butylcarbamoyl)-2-oxochromen-7-yl] 6-(1,3-dioxoisoindol-2-yl)hexanoate Traditional Name: 6-phthalimidohexanoic acid [3-(butylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C28H28N2O7 MolecularWeight: 504.53112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O)OC1=O

Isomeric SMILES

CCCCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O)OC1=O

InChI

InChI=1S/C28H28N2O7/c1-2-3-14-29-25(32)22-16-18-12-13-19(17-23(18)37-28(22)35)36-24(31)11-5-4-8-15-30-26(33)20-9-6-7-10-21(20)27(30)34/h6-7,9-10,12-13,16-17H,2-5,8,11,14-15H2,1H3,(H,29,32)