N-[[3-bromanyl-4-(5,9-diethoxy-6-oxidanylidene-8H-pyrrolo[3,4-g]quinolin-7-yl)phenyl]methylsulfonyl]-2-methyl-2-naphthalen-1-yl-propanamide

Systemtic Name: N-[[3-bromanyl-4-(5,9-diethoxy-6-oxidanylidene-8H-pyrrolo[3,4-g]quinolin-7-yl)phenyl]methylsulfonyl]-2-methyl-2-naphthalen-1-yl-propanamide Openeye Name: N-[[3-bromo-4-(5,9-diethoxy-6-oxo-8H-pyrrolo[3,4-g]quinolin-7-yl)phenyl]methylsulfonyl]-2-methyl-2-(1-naphthyl)propanamide CAS Name: N-[[3-bromo-4-(5,9-diethoxy-6-oxo-8H-pyrrolo[3,4-g]quinolin-7-yl)phenyl]methylsulfonyl]-2-methyl-2-(1-naphthalenyl)propanamide IUPAC Name: N-[[3-bromo-4-(5,9-diethoxy-6-oxo-8H-pyrrolo[3,4-g]quinolin-7-yl)phenyl]methylsulfonyl]-2-methyl-2-naphthalen-1-ylpropanamide Traditional Name: N-[3-bromo-4-(5,9-diethoxy-6-keto-8H-pyrrolo[3,4-g]quinolin-7-yl)benzyl]sulfonyl-2-methyl-2-(1-naphthyl)propionamide Formula: C36H34BrN3O6S MolecularWeight: 716.64066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2CN(C(=O)C2=C(C3=C1N=CC=C3)OCC)C4=C(C=C(C=C4)CS(=O)(=O)NC(=O)C(C)(C)C5=CC=CC6=CC=CC=C65)Br

Isomeric SMILES

CCOC1=C2CN(C(=O)C2=C(C3=C1N=CC=C3)OCC)C4=C(C=C(C=C4)CS(=O)(=O)NC(=O)C(C)(C)C5=CC=CC6=CC=CC=C65)Br

InChI

InChI=1S/C36H34BrN3O6S/c1-5-45-32-25-14-10-18-38-31(25)33(46-6-2)26-20-40(34(41)30(26)32)29-17-16-22(19-28(29)37)21-47(43,44)39-35(42)36(3,4)27-15-9-12-23-11-7-8-13-24(23)27/h7-19H,5-6,20-21H2,1-4H3,(H,39,42)