ethyl 4-[8-[(4-cyclopentylpiperazin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-chromen-3-yl]oxybenzoate

Systemtic Name: ethyl 4-[8-[(4-cyclopentylpiperazin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-chromen-3-yl]oxybenzoate Openeye Name: ethyl 4-[8-[(4-cyclopentylpiperazin-1-yl)methyl]-7-hydroxy-4-oxo-chromen-3-yl]oxybenzoate CAS Name: 4-[[8-[(4-cyclopentyl-1-piperazinyl)methyl]-7-hydroxy-4-oxo-1-benzopyran-3-yl]oxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[8-[(4-cyclopentylpiperazin-1-yl)methyl]-7-hydroxy-4-oxochromen-3-yl]oxybenzoate Traditional Name: 4-[8-[(4-cyclopentylpiperazino)methyl]-7-hydroxy-4-keto-chromen-3-yl]oxybenzoic acid ethyl ester Formula: C28H32N2O6 MolecularWeight: 492.56348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3CN4CCN(CC4)C5CCCC5)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3CN4CCN(CC4)C5CCCC5)O

InChI

InChI=1S/C28H32N2O6/c1-2-34-28(33)19-7-9-21(10-8-19)36-25-18-35-27-22(26(25)32)11-12-24(31)23(27)17-29-13-15-30(16-14-29)20-5-3-4-6-20/h7-12,18,20,31H,2-6,13-17H2,1H3