N-(4-bromanyl-2-methyl-phenyl)-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-8-keto-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinoline-13-carboxamide Formula: C25H21BrN2O2 MolecularWeight: 461.35044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2C3C4=CC=CC=C4CCN3C(=O)C5=CC=CC=C25

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2C3C4=CC=CC=C4CCN3C(=O)C5=CC=CC=C25

InChI

InChI=1S/C25H21BrN2O2/c1-15-14-17(26)10-11-21(15)27-24(29)22-19-8-4-5-9-20(19)25(30)28-13-12-16-6-2-3-7-18(16)23(22)28/h2-11,14,22-23H,12-13H2,1H3,(H,27,29)