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

Systemtic Name: ethanedioic acid; N'-[4-(3-methyl-4-propan-2-yl-phenoxy)butyl]ethane-1,2-diamine Openeye Name: N'-[4-(4-isopropyl-3-methyl-phenoxy)butyl]ethane-1,2-diamine; oxalic acid CAS Name: N'-[4-(3-methyl-4-propan-2-ylphenoxy)butyl]ethane-1,2-diamine; oxalic acid IUPAC Name: N'-[4-(3-methyl-4-propan-2-ylphenoxy)butyl]ethane-1,2-diamine; oxalic acid Traditional Name: 2-aminoethyl-[4-(4-isopropyl-3-methyl-phenoxy)butyl]amine; oxalic acid Formula: C18H30N2O5 MolecularWeight: 354.4412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2O.C2H2O4/c1-13(2)16-7-6-15(12-14(16)3)19-11-5-4-9-18-10-8-17;3-1(4)2(5)6/h6-7,12-13,18H,4-5,8-11,17H2,1-3H3;(H,3,4)(H,5,6)