(E)-4-oxidanylidene-4-(3-pyrrolidin-1-ylpropoxy)but-2-enoate; urea

Systemtic Name: (E)-4-oxidanylidene-4-(3-pyrrolidin-1-ylpropoxy)but-2-enoate; urea Openeye Name: (E)-4-oxo-4-(3-pyrrolidin-1-ylpropoxy)but-2-enoate; urea CAS Name: (E)-4-oxo-4-[3-(1-pyrrolidinyl)propoxy]-2-butenoate; urea IUPAC Name: (E)-4-oxo-4-(3-pyrrolidin-1-ylpropoxy)but-2-enoate; urea Traditional Name: (E)-4-keto-4-(3-pyrrolidinopropoxy)but-2-enoate; urea Formula: C12H20N3O5- MolecularWeight: 286.3043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC(=O)C=CC(=O)[O-].C(=O)(N)N

Isomeric SMILES

C1CCN(C1)CCCOC(=O)/C=C/C(=O)[O-].C(=O)(N)N

InChI

InChI=1S/C11H17NO4.CH4N2O/c13-10(14)4-5-11(15)16-9-3-8-12-6-1-2-7-12;2-1(3)4/h4-5H,1-3,6-9H2,(H,13,14);(H4,2,3,4)/p-1/b5-4+;