ethanedioic acid; N'-[3-(3-methyl-4-propan-2-yl-phenoxy)propyl]ethane-1,2-diamine

Systemtic Name: ethanedioic acid; N'-[3-(3-methyl-4-propan-2-yl-phenoxy)propyl]ethane-1,2-diamine Openeye Name: N'-[3-(4-isopropyl-3-methyl-phenoxy)propyl]ethane-1,2-diamine; oxalic acid CAS Name: N'-[3-(3-methyl-4-propan-2-ylphenoxy)propyl]ethane-1,2-diamine; oxalic acid IUPAC Name: N'-[3-(3-methyl-4-propan-2-ylphenoxy)propyl]ethane-1,2-diamine; oxalic acid Traditional Name: 2-aminoethyl-[3-(4-isopropyl-3-methyl-phenoxy)propyl]amine; oxalic acid Formula: C17H28N2O5 MolecularWeight: 340.41462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCNCCN)C(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCNCCN)C(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H26N2O.C2H2O4/c1-12(2)15-6-5-14(11-13(15)3)18-10-4-8-17-9-7-16;3-1(4)2(5)6/h5-6,11-12,17H,4,7-10,16H2,1-3H3;(H,3,4)(H,5,6)