ethanedioic acid; 2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]-N-(phenylmethyl)ethanamine

Systemtic Name: ethanedioic acid; 2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]-N-(phenylmethyl)ethanamine Openeye Name: N-benzyl-2-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]ethanamine; oxalic acid CAS Name: 2-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]-N-(phenylmethyl)ethanamine; oxalic acid IUPAC Name: N-benzyl-2-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]ethanamine; oxalic acid Traditional Name: benzyl-[2-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]ethyl]amine; oxalic acid Formula: C23H31NO6 MolecularWeight: 417.49534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCOCCNCC2=CC=CC=C2)C(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCCOCCNCC2=CC=CC=C2)C(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H29NO2.C2H2O4/c1-17(2)21-10-9-20(15-18(21)3)24-14-13-23-12-11-22-16-19-7-5-4-6-8-19;3-1(4)2(5)6/h4-10,15,17,22H,11-14,16H2,1-3H3;(H,3,4)(H,5,6)