methanamine; (E)-4-oxidanylidene-4-(2-pyridin-2-ylethoxy)but-2-enoate

Systemtic Name: methanamine; (E)-4-oxidanylidene-4-(2-pyridin-2-ylethoxy)but-2-enoate Openeye Name: methanamine; (E)-4-oxo-4-[2-(2-pyridyl)ethoxy]but-2-enoate CAS Name: methanamine; (E)-4-oxo-4-[2-(2-pyridinyl)ethoxy]-2-butenoate IUPAC Name: methanamine; (E)-4-oxo-4-(2-pyridin-2-ylethoxy)but-2-enoate Traditional Name: (E)-4-keto-4-[2-(2-pyridyl)ethoxy]but-2-enoate; methylamine Formula: C12H15N2O4- MolecularWeight: 251.2585

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Descriptors Computed from Structure

Canonical SMILES:

CN.C1=CC=NC(=C1)CCOC(=O)C=CC(=O)[O-]

Isomeric SMILES

CN.C1=CC=NC(=C1)CCOC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C11H11NO4.CH5N/c13-10(14)4-5-11(15)16-8-6-9-3-1-2-7-12-9;1-2/h1-5,7H,6,8H2,(H,13,14);2H2,1H3/p-1/b5-4+;