ethanedioate; 2-(phenoxymethyl)-1-(phenylmethyl)azetidine; hydrate

Systemtic Name: ethanedioate; 2-(phenoxymethyl)-1-(phenylmethyl)azetidine; hydrate Openeye Name: 1-benzyl-2-(phenoxymethyl)azetidine; oxalate; hydrate CAS Name: oxalate; 2-(phenoxymethyl)-1-(phenylmethyl)azetidine; hydrate IUPAC Name: 1-benzyl-2-(phenoxymethyl)azetidine; oxalate; hydrate Traditional Name: 1-benzyl-2-(phenoxymethyl)azetidine; oxalate; hydrate Formula: C19H21NO6-2 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1COC2=CC=CC=C2)CC3=CC=CC=C3.C(=O)(C(=O)[O-])[O-].O

Isomeric SMILES

C1CN(C1COC2=CC=CC=C2)CC3=CC=CC=C3.C(=O)(C(=O)[O-])[O-].O

InChI

InChI=1S/C17H19NO.C2H2O4.H2O/c1-3-7-15(8-4-1)13-18-12-11-16(18)14-19-17-9-5-2-6-10-17;3-1(4)2(5)6;/h1-10,16H,11-14H2;(H,3,4)(H,5,6);1H2/p-2