9-bromanyl-5-[[5-(hydroxymethyl)-2-methyl-phenyl]amino]-2H-benzo[h][2,6]naphthyridin-1-one

Systemtic Name: 9-bromanyl-5-[[5-(hydroxymethyl)-2-methyl-phenyl]amino]-2H-benzo[h][2,6]naphthyridin-1-one Openeye Name: 9-bromo-5-[5-(hydroxymethyl)-2-methyl-anilino]-2H-benzo[h][2,6]naphthyridin-1-one CAS Name: 9-bromo-5-[5-(hydroxymethyl)-2-methylanilino]-2H-benzo[h][2,6]naphthyridin-1-one IUPAC Name: 9-bromo-5-[5-(hydroxymethyl)-2-methylanilino]-2H-benzo[h][2,6]naphthyridin-1-one Traditional Name: 9-bromo-5-(2-methyl-5-methylol-anilino)-2H-benzo[h][2,6]naphthyridin-1-one Formula: C20H16BrN3O2 MolecularWeight: 410.26394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CO)NC2=NC3=C(C=C(C=C3)Br)C4=C2C=CNC4=O

Isomeric SMILES

CC1=C(C=C(C=C1)CO)NC2=NC3=C(C=C(C=C3)Br)C4=C2C=CNC4=O

InChI

InChI=1S/C20H16BrN3O2/c1-11-2-3-12(10-25)8-17(11)24-19-14-6-7-22-20(26)18(14)15-9-13(21)4-5-16(15)23-19/h2-9,25H,10H2,1H3,(H,22,26)(H,23,24)