7-[(1-oxidanylbutan-2-ylamino)methyl]-3,4-dihydroxanthen-9-one

Systemtic Name: 7-[(1-oxidanylbutan-2-ylamino)methyl]-3,4-dihydroxanthen-9-one Openeye Name: 7-[[1-(hydroxymethyl)propylamino]methyl]-3,4-dihydroxanthen-9-one CAS Name: 7-[(1-hydroxybutan-2-ylamino)methyl]-3,4-dihydroxanthen-9-one IUPAC Name: 7-[(1-hydroxybutan-2-ylamino)methyl]-3,4-dihydroxanthen-9-one Traditional Name: 7-[(1-methylolpropylamino)methyl]-3,4-dihydroxanthen-9-one Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC1=CC2=C(C=C1)OC3=C(C2=O)C=CCC3

Isomeric SMILES

CCC(CO)NCC1=CC2=C(C=C1)OC3=C(C2=O)C=CCC3

InChI

InChI=1S/C18H21NO3/c1-2-13(11-20)19-10-12-7-8-17-15(9-12)18(21)14-5-3-4-6-16(14)22-17/h3,5,7-9,13,19-20H,2,4,6,10-11H2,1H3