6-[(4-carbamimidoylphenyl)methoxy]-N-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-2-carboxamide; propanoate; tin(4+)

Systemtic Name: 6-[(4-carbamimidoylphenyl)methoxy]-N-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-2-carboxamide; propanoate; tin(4+) Openeye Name: stannic; 6-[(4-carbamimidoylphenyl)methoxy]-N-methyl-1-oxo-3,4-dihydroisoquinoline-2-carboxamide; propanoate CAS Name: 6-[(4-carbamimidoylphenyl)methoxy]-N-methyl-1-oxo-3,4-dihydroisoquinoline-2-carboxamide; propanoate; tin(4+) IUPAC Name: 6-[(4-carbamimidoylphenyl)methoxy]-N-methyl-1-oxo-3,4-dihydroisoquinoline-2-carboxamide; propanoate; tin(4+) Traditional Name: stannic; 6-(4-amidinobenzyl)oxy-1-keto-N-methyl-3,4-dihydroisoquinoline-2-carboxamide; propionate Formula: C31H40N4O11Sn MolecularWeight: 763.3795

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CNC(=O)N1CCC2=C(C1=O)C=CC(=C2)OCC3=CC=C(C=C3)C(=N)N.[Sn+4]

Isomeric SMILES

CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CNC(=O)N1CCC2=C(C1=O)C=CC(=C2)OCC3=CC=C(C=C3)C(=N)N.[Sn+4]

InChI

InChI=1S/C19H20N4O3.4C3H6O2.Sn/c1-22-19(25)23-9-8-14-10-15(6-7-16(14)18(23)24)26-11-12-2-4-13(5-3-12)17(20)21;4*1-2-3(4)5;/h2-7,10H,8-9,11H2,1H3,(H3,20,21)(H,22,25);4*2H2,1H3,(H,4,5);/q;;;;;+4/p-4