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

Systemtic Name: methyl 4-[2-methyl-8-[(3-methylpiperidin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-chromen-3-yl]oxybenzoate Openeye Name: methyl 4-[7-hydroxy-2-methyl-8-[(3-methyl-1-piperidyl)methyl]-4-oxo-chromen-3-yl]oxybenzoate CAS Name: 4-[[7-hydroxy-2-methyl-8-[(3-methyl-1-piperidinyl)methyl]-4-oxo-1-benzopyran-3-yl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[7-hydroxy-2-methyl-8-[(3-methylpiperidin-1-yl)methyl]-4-oxochromen-3-yl]oxybenzoate Traditional Name: 4-[7-hydroxy-4-keto-2-methyl-8-[(3-methylpiperidino)methyl]chromen-3-yl]oxybenzoic acid methyl ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=C(C=C4)C(=O)OC)C)O

Isomeric SMILES

CC1CCCN(C1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=C(C=C4)C(=O)OC)C)O

InChI

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