(5Z)-5-[methoxy(oxidanyl)methylidene]-3-(phenylmethyl)imidazol-4-one; phenylmethanamine

Systemtic Name: (5Z)-5-[methoxy(oxidanyl)methylidene]-3-(phenylmethyl)imidazol-4-one; phenylmethanamine Openeye Name: (5Z)-3-benzyl-5-[hydroxy(methoxy)methylene]imidazol-4-one; phenylmethanamine CAS Name: (5Z)-5-[hydroxy(methoxy)methylidene]-3-(phenylmethyl)-4-imidazolone; phenylmethanamine IUPAC Name: (5Z)-3-benzyl-5-[hydroxy(methoxy)methylidene]imidazol-4-one; phenylmethanamine Traditional Name: benzylamine; (5Z)-3-benzyl-5-[hydroxy(methoxy)methylene]-2-imidazolin-4-one Formula: C19H21N3O3 MolecularWeight: 339.38834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=C1C(=O)N(C=N1)CC2=CC=CC=C2)O.C1=CC=C(C=C1)CN

Isomeric SMILES

CO/C(=C\1/C(=O)N(C=N1)CC2=CC=CC=C2)/O.C1=CC=C(C=C1)CN

InChI

InChI=1S/C12H12N2O3.C7H9N/c1-17-12(16)10-11(15)14(8-13-10)7-9-5-3-2-4-6-9;8-6-7-4-2-1-3-5-7/h2-6,8,16H,7H2,1H3;1-5H,6,8H2/b12-10-;