4-[5-(diethylamino)-3,3-dimethyl-pentoxy]benzoate

Systemtic Name: 4-[5-(diethylamino)-3,3-dimethyl-pentoxy]benzoate Openeye Name: 4-[5-(diethylamino)-3,3-dimethyl-pentoxy]benzoate CAS Name: 4-[5-(diethylamino)-3,3-dimethylpentoxy]benzoate IUPAC Name: 4-[5-(diethylamino)-3,3-dimethylpentoxy]benzoate Traditional Name: 4-[5-(diethylamino)-3,3-dimethyl-pentoxy]benzoate Formula: C18H28NO3- MolecularWeight: 306.41982

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(C)(C)CCOC1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

CCN(CC)CCC(C)(C)CCOC1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C18H29NO3/c1-5-19(6-2)13-11-18(3,4)12-14-22-16-9-7-15(8-10-16)17(20)21/h7-10H,5-6,11-14H2,1-4H3,(H,20,21)/p-1