3-methyl-1-[3-methyl-2-oxidanyl-4-[[3-(pyridin-4-ylamino)phenyl]methoxy]phenyl]butan-1-one

Systemtic Name: 3-methyl-1-[3-methyl-2-oxidanyl-4-[[3-(pyridin-4-ylamino)phenyl]methoxy]phenyl]butan-1-one Openeye Name: 1-[2-hydroxy-3-methyl-4-[[3-(4-pyridylamino)phenyl]methoxy]phenyl]-3-methyl-butan-1-one CAS Name: 1-[2-hydroxy-3-methyl-4-[[3-(pyridin-4-ylamino)phenyl]methoxy]phenyl]-3-methyl-1-butanone IUPAC Name: 1-[2-hydroxy-3-methyl-4-[[3-(pyridin-4-ylamino)phenyl]methoxy]phenyl]-3-methylbutan-1-one Traditional Name: 1-[2-hydroxy-3-methyl-4-[3-(4-pyridylamino)benzyl]oxy-phenyl]-3-methyl-butan-1-one Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCC2=CC(=CC=C2)NC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCC2=CC(=CC=C2)NC3=CC=NC=C3

InChI

InChI=1S/C24H26N2O3/c1-16(2)13-22(27)21-7-8-23(17(3)24(21)28)29-15-18-5-4-6-20(14-18)26-19-9-11-25-12-10-19/h4-12,14,16,28H,13,15H2,1-3H3,(H,25,26)