sodium (2R)-2-(phenylmethoxycarbonylamino)-3-(6-tributylstannyl-1H-indol-3-yl)propanoate

Systemtic Name: sodium (2R)-2-(phenylmethoxycarbonylamino)-3-(6-tributylstannyl-1H-indol-3-yl)propanoate Openeye Name: sodium (2R)-2-(benzyloxycarbonylamino)-3-(6-tributylstannyl-1H-indol-3-yl)propanoate CAS Name: sodium (2R)-2-(phenylmethoxycarbonylamino)-3-(6-tributylstannyl-1H-indol-3-yl)propanoate IUPAC Name: sodium (2R)-2-(phenylmethoxycarbonylamino)-3-(6-tributylstannyl-1H-indol-3-yl)propanoate Traditional Name: sodium (2R)-2-(benzyloxycarbonylamino)-3-(6-tributylstannyl-1H-indol-3-yl)propionate Formula: C31H43N2NaO4Sn MolecularWeight: 649.38389

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)C1=CC2=C(C=C1)C(=CN2)CC(C(=O)[O-])NC(=O)OCC3=CC=CC=C3.[Na+]

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)C1=CC2=C(C=C1)C(=CN2)C[C@H](C(=O)[O-])NC(=O)OCC3=CC=CC=C3.[Na+]

InChI

InChI=1S/C19H17N2O4.3C4H9.Na.Sn/c22-18(23)17(10-14-11-20-16-9-5-4-8-15(14)16)21-19(24)25-12-13-6-2-1-3-7-13;3*1-3-4-2;;/h1-4,6-9,11,17,20H,10,12H2,(H,21,24)(H,22,23);3*1,3-4H2,2H3;;/q;;;;+1;/p-1/t17-;;;;;/m1...../s1