ethanedioic acid; N-[3-(4-phenylphenoxy)propyl]cyclopentanamine

Systemtic Name: ethanedioic acid; N-[3-(4-phenylphenoxy)propyl]cyclopentanamine Openeye Name: oxalic acid; N-[3-(4-phenylphenoxy)propyl]cyclopentanamine CAS Name: oxalic acid; N-[3-(4-phenylphenoxy)propyl]cyclopentanamine IUPAC Name: oxalic acid; N-[3-(4-phenylphenoxy)propyl]cyclopentanamine Traditional Name: cyclopentyl-[3-(4-phenylphenoxy)propyl]amine; oxalic acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NCCCOC2=CC=C(C=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(C1)NCCCOC2=CC=C(C=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25NO.C2H2O4/c1-2-7-17(8-3-1)18-11-13-20(14-12-18)22-16-6-15-21-19-9-4-5-10-19;3-1(4)2(5)6/h1-3,7-8,11-14,19,21H,4-6,9-10,15-16H2;(H,3,4)(H,5,6)