ethyl 4-[8-[[cyclohexyl(prop-2-enyl)amino]methyl]-7-oxidanyl-4-oxidanylidene-chromen-3-yl]oxybenzoate

Systemtic Name: ethyl 4-[8-[[cyclohexyl(prop-2-enyl)amino]methyl]-7-oxidanyl-4-oxidanylidene-chromen-3-yl]oxybenzoate Openeye Name: ethyl 4-[8-[[allyl(cyclohexyl)amino]methyl]-7-hydroxy-4-oxo-chromen-3-yl]oxybenzoate CAS Name: 4-[[8-[[cyclohexyl(prop-2-enyl)amino]methyl]-7-hydroxy-4-oxo-1-benzopyran-3-yl]oxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[8-[[cyclohexyl(prop-2-enyl)amino]methyl]-7-hydroxy-4-oxochromen-3-yl]oxybenzoate Traditional Name: 4-[8-[[allyl(cyclohexyl)amino]methyl]-7-hydroxy-4-keto-chromen-3-yl]oxybenzoic acid ethyl ester Formula: C28H31NO6 MolecularWeight: 477.54884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3CN(CC=C)C4CCCCC4)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3CN(CC=C)C4CCCCC4)O

InChI

InChI=1S/C28H31NO6/c1-3-16-29(20-8-6-5-7-9-20)17-23-24(30)15-14-22-26(31)25(18-34-27(22)23)35-21-12-10-19(11-13-21)28(32)33-4-2/h3,10-15,18,20,30H,1,4-9,16-17H2,2H3