methyl (3aS,7aR)-2-azanyl-1,3a,5,7a-tetrahydroimidazo[4,5-b]pyridine-4-carboxylate

Systemtic Name: methyl (3aS,7aR)-2-azanyl-1,3a,5,7a-tetrahydroimidazo[4,5-b]pyridine-4-carboxylate Openeye Name: methyl (3aS,7aR)-2-amino-1,3a,5,7a-tetrahydroimidazo[4,5-b]pyridine-4-carboxylate CAS Name: (3aS,7aR)-2-amino-1,3a,5,7a-tetrahydroimidazo[4,5-b]pyridine-4-carboxylic acid methyl ester IUPAC Name: methyl (3aS,7aR)-2-amino-1,3a,5,7a-tetrahydroimidazo[4,5-b]pyridine-4-carboxylate Traditional Name: (3aS,7aR)-2-amino-1,3a,5,7a-tetrahydroimidazo[4,5-b]pyridine-4-carboxylic acid methyl ester Formula: C8H12N4O2 MolecularWeight: 196.20648

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CC=CC2C1N=C(N2)N

Isomeric SMILES

COC(=O)N1CC=C[C@@H]2[C@H]1N=C(N2)N

InChI

InChI=1S/C8H12N4O2/c1-14-8(13)12-4-2-3-5-6(12)11-7(9)10-5/h2-3,5-6H,4H2,1H3,(H3,9,10,11)/t5-,6+/m1/s1