6-azanylhexyl 4-(2-hydroxyethyl)-2-(3-oxidanylidenepropyl)pyridine-3-carboxylate

Systemtic Name: 6-azanylhexyl 4-(2-hydroxyethyl)-2-(3-oxidanylidenepropyl)pyridine-3-carboxylate Openeye Name: 6-aminohexyl 4-(2-hydroxyethyl)-2-(3-oxopropyl)pyridine-3-carboxylate CAS Name: 4-(2-hydroxyethyl)-2-(3-oxopropyl)-3-pyridinecarboxylic acid 6-aminohexyl ester IUPAC Name: 6-aminohexyl 4-(2-hydroxyethyl)-2-(3-oxopropyl)pyridine-3-carboxylate Traditional Name: 4-(2-hydroxyethyl)-2-(3-ketopropyl)nicotinic acid 6-aminohexyl ester Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C(=C1CCO)C(=O)OCCCCCCN)CCC=O

Isomeric SMILES

C1=CN=C(C(=C1CCO)C(=O)OCCCCCCN)CCC=O

InChI

InChI=1S/C17H26N2O4/c18-9-3-1-2-4-13-23-17(22)16-14(8-12-21)7-10-19-15(16)6-5-11-20/h7,10-11,21H,1-6,8-9,12-13,18H2