2-hydroxyethyl 2-azanyl-3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-carboxylate

Systemtic Name: 2-hydroxyethyl 2-azanyl-3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-carboxylate Openeye Name: 2-hydroxyethyl 2-amino-3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-carboxylate CAS Name: 2-amino-3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-carboxylic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 2-amino-3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-carboxylate Traditional Name: 2-amino-3-cyano-1-pyrindan-1-ium-4-carboxylic acid 2-hydroxyethyl ester Formula: C12H14N3O3+ MolecularWeight: 248.25786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)[NH+]=C(C(=C2C(=O)OCCO)C#N)N

Isomeric SMILES

C1CC2=C(C1)[NH+]=C(C(=C2C(=O)OCCO)C#N)N

InChI

InChI=1S/C12H13N3O3/c13-6-8-10(12(17)18-5-4-16)7-2-1-3-9(7)15-11(8)14/h16H,1-5H2,(H2,14,15)/p+1