hexyl pyridine-3-carboxylate; 1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol

Systemtic Name: hexyl pyridine-3-carboxylate; 1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol Openeye Name: hexyl pyridine-3-carboxylate; 1-(isopropylamino)-3-(1-naphthyloxy)propan-2-ol CAS Name: 1-(1-naphthalenyloxy)-3-(propan-2-ylamino)-2-propanol; 3-pyridinecarboxylic acid hexyl ester IUPAC Name: hexyl pyridine-3-carboxylate; 1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol Traditional Name: 1-(isopropylamino)-3-(1-naphthoxy)propan-2-ol; nicotinic acid hexyl ester Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CN=CC=C1.CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O

Isomeric SMILES

CCCCCCOC(=O)C1=CN=CC=C1.CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O

InChI

InChI=1S/C16H21NO2.C12H17NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16;1-2-3-4-5-9-15-12(14)11-7-6-8-13-10-11/h3-9,12,14,17-18H,10-11H2,1-2H3;6-8,10H,2-5,9H2,1H3