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

Systemtic Name: 2-chloranyl-7-[[methyl(1-oxidanylbutan-2-yl)amino]methyl]-3,4-dihydroxanthen-9-one Openeye Name: 2-chloro-7-[[1-(hydroxymethyl)propyl-methyl-amino]methyl]-3,4-dihydroxanthen-9-one CAS Name: 2-chloro-7-[[1-hydroxybutan-2-yl(methyl)amino]methyl]-3,4-dihydroxanthen-9-one IUPAC Name: 2-chloro-7-[[1-hydroxybutan-2-yl(methyl)amino]methyl]-3,4-dihydroxanthen-9-one Traditional Name: 2-chloro-7-[[methyl(1-methylolpropyl)amino]methyl]-3,4-dihydroxanthen-9-one Formula: C19H22ClNO3 MolecularWeight: 347.83588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)N(C)CC1=CC2=C(C=C1)OC3=C(C2=O)C=C(CC3)Cl

Isomeric SMILES

CCC(CO)N(C)CC1=CC2=C(C=C1)OC3=C(C2=O)C=C(CC3)Cl

InChI

InChI=1S/C19H22ClNO3/c1-3-14(11-22)21(2)10-12-4-6-17-15(8-12)19(23)16-9-13(20)5-7-18(16)24-17/h4,6,8-9,14,22H,3,5,7,10-11H2,1-2H3