propyl 4-[2-methyl-7-oxidanyl-4-oxidanylidene-8-(pyrrolidin-1-ylmethyl)chromen-3-yl]oxybenzoate

Systemtic Name: propyl 4-[2-methyl-7-oxidanyl-4-oxidanylidene-8-(pyrrolidin-1-ylmethyl)chromen-3-yl]oxybenzoate Openeye Name: propyl 4-[7-hydroxy-2-methyl-4-oxo-8-(pyrrolidin-1-ylmethyl)chromen-3-yl]oxybenzoate CAS Name: 4-[[7-hydroxy-2-methyl-4-oxo-8-(1-pyrrolidinylmethyl)-1-benzopyran-3-yl]oxy]benzoic acid propyl ester IUPAC Name: propyl 4-[7-hydroxy-2-methyl-4-oxo-8-(pyrrolidin-1-ylmethyl)chromen-3-yl]oxybenzoate Traditional Name: 4-[7-hydroxy-4-keto-2-methyl-8-(pyrrolidinomethyl)chromen-3-yl]oxybenzoic acid propyl ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN4CCCC4)O)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN4CCCC4)O)C

InChI

InChI=1S/C25H27NO6/c1-3-14-30-25(29)17-6-8-18(9-7-17)32-23-16(2)31-24-19(22(23)28)10-11-21(27)20(24)15-26-12-4-5-13-26/h6-11,27H,3-5,12-15H2,1-2H3