N-methyl-1-(2-tributylstannylphenyl)isoquinoline-3-carboxamide

Systemtic Name: N-methyl-1-(2-tributylstannylphenyl)isoquinoline-3-carboxamide Openeye Name: N-methyl-1-(2-tributylstannylphenyl)isoquinoline-3-carboxamide CAS Name: N-methyl-1-(2-tributylstannylphenyl)-3-isoquinolinecarboxamide IUPAC Name: N-methyl-1-(2-tributylstannylphenyl)isoquinoline-3-carboxamide Traditional Name: N-methyl-1-(2-tributylstannylphenyl)isoquinoline-3-carboxamide Formula: C29H40N2OSn MolecularWeight: 551.3507

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)C1=CC=CC=C1C2=NC(=CC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)C1=CC=CC=C1C2=NC(=CC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C17H13N2O.3C4H9.Sn/c1-18-17(20)15-11-13-9-5-6-10-14(13)16(19-15)12-7-3-2-4-8-12;3*1-3-4-2;/h2-7,9-11H,1H3,(H,18,20);3*1,3-4H2,2H3;