3-methylbutyl 2-(diethylamino)benzoate; 3-methylbutyl 2-(dimethylamino)benzoate

Systemtic Name: 3-methylbutyl 2-(diethylamino)benzoate; 3-methylbutyl 2-(dimethylamino)benzoate Openeye Name: isopentyl 2-(diethylamino)benzoate; isopentyl 2-(dimethylamino)benzoate CAS Name: 2-(diethylamino)benzoic acid 3-methylbutyl ester; 2-(dimethylamino)benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-(diethylamino)benzoate; 3-methylbutyl 2-(dimethylamino)benzoate Traditional Name: 2-(diethylamino)benzoic acid isoamyl ester; 2-(dimethylamino)benzoic acid isoamyl ester Formula: C30H46N2O4 MolecularWeight: 498.69724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=CC=C1C(=O)OCCC(C)C.CC(C)CCOC(=O)C1=CC=CC=C1N(C)C

Isomeric SMILES

CCN(CC)C1=CC=CC=C1C(=O)OCCC(C)C.CC(C)CCOC(=O)C1=CC=CC=C1N(C)C

InChI

InChI=1S/C16H25NO2.C14H21NO2/c1-5-17(6-2)15-10-8-7-9-14(15)16(18)19-12-11-13(3)4;1-11(2)9-10-17-14(16)12-7-5-6-8-13(12)15(3)4/h7-10,13H,5-6,11-12H2,1-4H3;5-8,11H,9-10H2,1-4H3