methyl (4aS,10bR)-3,4,4a,5,6,10b-hexahydro-2H-1,9-phenanthroline-1-carboxylate

Systemtic Name: methyl (4aS,10bR)-3,4,4a,5,6,10b-hexahydro-2H-1,9-phenanthroline-1-carboxylate Openeye Name: methyl (4aS,10bR)-3,4,4a,5,6,10b-hexahydro-2H-1,9-phenanthroline-1-carboxylate CAS Name: (4aS,10bR)-3,4,4a,5,6,10b-hexahydro-2H-1,9-phenanthroline-1-carboxylic acid methyl ester IUPAC Name: methyl (4aS,10bR)-3,4,4a,5,6,10b-hexahydro-2H-1,9-phenanthroline-1-carboxylate Traditional Name: (4aS,10bR)-3,4,4a,5,6,10b-hexahydro-2H-1,9-phenanthroline-1-carboxylic acid methyl ester Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCC2C1C3=C(CC2)C=CN=C3

Isomeric SMILES

COC(=O)N1CCC[C@H]2[C@@H]1C3=C(CC2)C=CN=C3

InChI

InChI=1S/C14H18N2O2/c1-18-14(17)16-8-2-3-11-5-4-10-6-7-15-9-12(10)13(11)16/h6-7,9,11,13H,2-5,8H2,1H3/t11-,13-/m1/s1