4-(diethylamino)-2-pentyl-benzoate

Systemtic Name: 4-(diethylamino)-2-pentyl-benzoate Openeye Name: 4-(diethylamino)-2-pentyl-benzoate CAS Name: 4-(diethylamino)-2-pentylbenzoate IUPAC Name: 4-(diethylamino)-2-pentylbenzoate Traditional Name: 2-amyl-4-(diethylamino)benzoate Formula: C16H24NO2- MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1)N(CC)CC)C(=O)[O-]

Isomeric SMILES

CCCCCC1=C(C=CC(=C1)N(CC)CC)C(=O)[O-]

InChI

InChI=1S/C16H25NO2/c1-4-7-8-9-13-12-14(17(5-2)6-3)10-11-15(13)16(18)19/h10-12H,4-9H2,1-3H3,(H,18,19)/p-1