2-[3,4-bis(oxidanyl)phenyl]-7-[2-oxidanyl-3-(propan-2-ylamino)propoxy]chromen-4-one

Systemtic Name: 2-[3,4-bis(oxidanyl)phenyl]-7-[2-oxidanyl-3-(propan-2-ylamino)propoxy]chromen-4-one Openeye Name: 2-(3,4-dihydroxyphenyl)-7-[2-hydroxy-3-(isopropylamino)propoxy]chromen-4-one CAS Name: 2-(3,4-dihydroxyphenyl)-7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1-benzopyran-4-one IUPAC Name: 2-(3,4-dihydroxyphenyl)-7-[2-hydroxy-3-(propan-2-ylamino)propoxy]chromen-4-one Traditional Name: 2-(3,4-dihydroxyphenyl)-7-[2-hydroxy-3-(isopropylamino)propoxy]chromone Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC(=C(C=C3)O)O)O

Isomeric SMILES

CC(C)NCC(COC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC(=C(C=C3)O)O)O

InChI

InChI=1S/C21H23NO6/c1-12(2)22-10-14(23)11-27-15-4-5-16-18(25)9-20(28-21(16)8-15)13-3-6-17(24)19(26)7-13/h3-9,12,14,22-24,26H,10-11H2,1-2H3