[(2S)-2-(diethylamino)-3-methyl-pentyl] 2-butoxy-4-oxidanyl-benzoate

Systemtic Name: [(2S)-2-(diethylamino)-3-methyl-pentyl] 2-butoxy-4-oxidanyl-benzoate Openeye Name: [(2S)-2-(diethylamino)-3-methyl-pentyl] 2-butoxy-4-hydroxy-benzoate CAS Name: 2-butoxy-4-hydroxybenzoic acid [(2S)-2-(diethylamino)-3-methylpentyl] ester IUPAC Name: [(2S)-2-(diethylamino)-3-methylpentyl] 2-butoxy-4-hydroxybenzoate Traditional Name: 2-butoxy-4-hydroxy-benzoic acid [(2S)-2-(diethylamino)-3-methyl-pentyl] ester Formula: C21H35NO4 MolecularWeight: 365.5069

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)O)C(=O)OCC(C(C)CC)N(CC)CC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)O)C(=O)OC[C@H](C(C)CC)N(CC)CC

InChI

InChI=1S/C21H35NO4/c1-6-10-13-25-20-14-17(23)11-12-18(20)21(24)26-15-19(16(5)7-2)22(8-3)9-4/h11-12,14,16,19,23H,6-10,13,15H2,1-5H3/t16?,19-/m1/s1