4-(4-chloranylphenoxy)-N-phenethyl-butan-1-amine; ethanedioic acid

Systemtic Name: 4-(4-chloranylphenoxy)-N-phenethyl-butan-1-amine; ethanedioic acid Openeye Name: 4-(4-chlorophenoxy)-N-phenethyl-butan-1-amine; oxalic acid CAS Name: 4-(4-chlorophenoxy)-N-phenethyl-1-butanamine; oxalic acid IUPAC Name: 4-(4-chlorophenoxy)-N-phenethylbutan-1-amine; oxalic acid Traditional Name: 4-(4-chlorophenoxy)butyl-phenethyl-amine; oxalic acid Formula: C20H24ClNO5 MolecularWeight: 393.86126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCCCCOC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNCCCCOC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H22ClNO.C2H2O4/c19-17-8-10-18(11-9-17)21-15-5-4-13-20-14-12-16-6-2-1-3-7-16;3-1(4)2(5)6/h1-3,6-11,20H,4-5,12-15H2;(H,3,4)(H,5,6)