3-[4-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxidanylidene-ethoxy]phenyl]-8-methoxy-chromen-2-one

Systemtic Name: 3-[4-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxidanylidene-ethoxy]phenyl]-8-methoxy-chromen-2-one Openeye Name: 3-[4-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxo-ethoxy]phenyl]-8-methoxy-chromen-2-one CAS Name: 3-[4-[2-[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]-2-oxoethoxy]phenyl]-8-methoxy-1-benzopyran-2-one IUPAC Name: 3-[4-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethoxy]phenyl]-8-methoxychromen-2-one Traditional Name: 3-[4-[2-keto-2-[(2S)-2-methylolpyrrolidino]ethoxy]phenyl]-8-methoxy-coumarin Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C3=CC=C(C=C3)OCC(=O)N4CCCC4CO

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C3=CC=C(C=C3)OCC(=O)N4CCC[C@H]4CO

InChI

InChI=1S/C23H23NO6/c1-28-20-6-2-4-16-12-19(23(27)30-22(16)20)15-7-9-18(10-8-15)29-14-21(26)24-11-3-5-17(24)13-25/h2,4,6-10,12,17,25H,3,5,11,13-14H2,1H3/t17-/m0/s1