cyclopropanamine; (E)-4-oxidanylidene-4-[(E)-2-pyridin-3-ylethenoxy]but-2-enoate

Systemtic Name: cyclopropanamine; (E)-4-oxidanylidene-4-[(E)-2-pyridin-3-ylethenoxy]but-2-enoate Openeye Name: cyclopropanamine; (E)-4-oxo-4-[(E)-2-(3-pyridyl)vinyloxy]but-2-enoate CAS Name: cyclopropanamine; (E)-4-oxo-4-[(E)-2-(3-pyridinyl)ethenoxy]-2-butenoate IUPAC Name: cyclopropanamine; (E)-4-oxo-4-[(E)-2-pyridin-3-ylethenoxy]but-2-enoate Traditional Name: cyclopropylamine; (E)-4-keto-4-[(E)-2-(3-pyridyl)vinyloxy]but-2-enoate Formula: C14H15N2O4- MolecularWeight: 275.2799

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N.C1=CC(=CN=C1)C=COC(=O)C=CC(=O)[O-]

Isomeric SMILES

C1CC1N.C1=CC(=CN=C1)/C=C/OC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C11H9NO4.C3H7N/c13-10(14)3-4-11(15)16-7-5-9-2-1-6-12-8-9;4-3-1-2-3/h1-8H,(H,13,14);3H,1-2,4H2/p-1/b4-3+,7-5+;