ethanedioic acid; N-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]butan-2-amine

Systemtic Name: ethanedioic acid; N-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]butan-2-amine Openeye Name: N-[2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]ethyl]butan-2-amine; oxalic acid CAS Name: oxalic acid; N-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]-2-butanamine IUPAC Name: oxalic acid; N-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]butan-2-amine Traditional Name: 2-(4-cumylphenoxy)ethyl-sec-butyl-amine; oxalic acid Formula: C23H31NO5 MolecularWeight: 401.49594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCOC1=CC=C(C=C1)C(C)(C)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCCOC1=CC=C(C=C1)C(C)(C)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H29NO.C2H2O4/c1-5-17(2)22-15-16-23-20-13-11-19(12-14-20)21(3,4)18-9-7-6-8-10-18;3-1(4)2(5)6/h6-14,17,22H,5,15-16H2,1-4H3;(H,3,4)(H,5,6)