2-adamantyl 6-(aminomethyl)pyridine-3-carboxylate

Systemtic Name: 2-adamantyl 6-(aminomethyl)pyridine-3-carboxylate Openeye Name: 2-adamantyl 6-(aminomethyl)pyridine-3-carboxylate CAS Name: 6-(aminomethyl)-3-pyridinecarboxylic acid 2-adamantyl ester IUPAC Name: 2-adamantyl 6-(aminomethyl)pyridine-3-carboxylate Traditional Name: 6-(aminomethyl)nicotinic acid 2-adamantyl ester Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3OC(=O)C4=CN=C(C=C4)CN

Isomeric SMILES

C1C2CC3CC1CC(C2)C3OC(=O)C4=CN=C(C=C4)CN

InChI

InChI=1S/C17H22N2O2/c18-8-15-2-1-12(9-19-15)17(20)21-16-13-4-10-3-11(6-13)7-14(16)5-10/h1-2,9-11,13-14,16H,3-8,18H2