[3-(dimethylamino)-2,2-dimethyl-propyl] 2-(phenylmethyl)pentanoate; ethanedioic acid

Systemtic Name: [3-(dimethylamino)-2,2-dimethyl-propyl] 2-(phenylmethyl)pentanoate; ethanedioic acid Openeye Name: [3-(dimethylamino)-2,2-dimethyl-propyl] 2-benzylpentanoate; oxalic acid CAS Name: oxalic acid; 2-(phenylmethyl)pentanoic acid [3-(dimethylamino)-2,2-dimethylpropyl] ester IUPAC Name: [3-(dimethylamino)-2,2-dimethylpropyl] 2-benzylpentanoate; oxalic acid Traditional Name: 2-benzylvaleric acid [3-(dimethylamino)-2,2-dimethyl-propyl] ester; oxalic acid Formula: C21H33NO6 MolecularWeight: 395.48982

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1)C(=O)OCC(C)(C)CN(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCC(CC1=CC=CC=C1)C(=O)OCC(C)(C)CN(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H31NO2.C2H2O4/c1-6-10-17(13-16-11-8-7-9-12-16)18(21)22-15-19(2,3)14-20(4)5;3-1(4)2(5)6/h7-9,11-12,17H,6,10,13-15H2,1-5H3;(H,3,4)(H,5,6)