N-(4-bromanyl-2-methyl-phenyl)-2,3-dimethoxy-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2,3-dimethoxy-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2,3-dimethoxy-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-2,3-dimethoxy-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2,3-dimethoxy-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-8-keto-2,3-dimethoxy-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinoline-13-carboxamide Formula: C27H25BrN2O4 MolecularWeight: 521.4024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25BrN2O4/c1-15-12-17(28)8-9-21(15)29-26(31)24-18-6-4-5-7-19(18)27(32)30-11-10-16-13-22(33-2)23(34-3)14-20(16)25(24)30/h4-9,12-14,24-25H,10-11H2,1-3H3,(H,29,31)