methyl 2-methoxy-3-methyl-5-[(E)-6-(methylamino)-6-oxidanylidene-1-tributylstannyl-hex-1-enyl]benzoate

Systemtic Name: methyl 2-methoxy-3-methyl-5-[(E)-6-(methylamino)-6-oxidanylidene-1-tributylstannyl-hex-1-enyl]benzoate Openeye Name: methyl 2-methoxy-3-methyl-5-[(E)-6-(methylamino)-6-oxo-1-tributylstannyl-hex-1-enyl]benzoate CAS Name: 2-methoxy-3-methyl-5-[(E)-6-(methylamino)-6-oxo-1-tributylstannylhex-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-3-methyl-5-[(E)-6-(methylamino)-6-oxo-1-tributylstannylhex-1-enyl]benzoate Traditional Name: 5-[(E)-6-keto-6-(methylamino)-1-tributylstannyl-hex-1-enyl]-2-methoxy-3-methyl-benzoic acid methyl ester Formula: C29H49NO4Sn MolecularWeight: 594.41366

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)C(=CCCCC(=O)NC)C1=CC(=C(C(=C1)C)OC)C(=O)OC

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)/C(=C/CCCC(=O)NC)/C1=CC(=C(C(=C1)C)OC)C(=O)OC

InChI

InChI=1S/C17H22NO4.3C4H9.Sn/c1-12-10-13(8-6-5-7-9-15(19)18-2)11-14(16(12)21-3)17(20)22-4;3*1-3-4-2;/h6,10-11H,5,7,9H2,1-4H3,(H,18,19);3*1,3-4H2,2H3;