5-bromanyl-6-(3-methylpiperidin-1-yl)-2-phenylmethoxy-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 5-bromanyl-6-(3-methylpiperidin-1-yl)-2-phenylmethoxy-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-benzyloxy-5-bromo-6-(3-methyl-1-piperidyl)benzo[de]isoquinoline-1,3-dione CAS Name: 5-bromo-6-(3-methyl-1-piperidinyl)-2-phenylmethoxybenzo[de]isoquinoline-1,3-dione IUPAC Name: 5-bromo-6-(3-methylpiperidin-1-yl)-2-phenylmethoxybenzo[de]isoquinoline-1,3-dione Traditional Name: 2-benzoxy-5-bromo-6-(3-methylpiperidino)benzo[de]isoquinoline-1,3-quinone Formula: C25H23BrN2O3 MolecularWeight: 479.36572

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C3C4=C2C=CC=C4C(=O)N(C3=O)OCC5=CC=CC=C5)Br

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C3C4=C2C=CC=C4C(=O)N(C3=O)OCC5=CC=CC=C5)Br

InChI

InChI=1S/C25H23BrN2O3/c1-16-7-6-12-27(14-16)23-18-10-5-11-19-22(18)20(13-21(23)26)25(30)28(24(19)29)31-15-17-8-3-2-4-9-17/h2-5,8-11,13,16H,6-7,12,14-15H2,1H3