(E)-2-azanyl-7-methoxy-7-oxidanylidene-hept-4-enoate

Systemtic Name: (E)-2-azanyl-7-methoxy-7-oxidanylidene-hept-4-enoate Openeye Name: (E)-2-amino-7-methoxy-7-oxo-hept-4-enoate CAS Name: (E)-2-amino-7-methoxy-7-oxo-4-heptenoate IUPAC Name: (E)-2-amino-7-methoxy-7-oxohept-4-enoate Traditional Name: (E)-2-amino-7-keto-7-methoxy-hept-4-enoate Formula: C8H12NO4- MolecularWeight: 186.18518

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC=CCC(C(=O)[O-])N

Isomeric SMILES

COC(=O)C/C=C/CC(C(=O)[O-])N

InChI

InChI=1S/C8H13NO4/c1-13-7(10)5-3-2-4-6(9)8(11)12/h2-3,6H,4-5,9H2,1H3,(H,11,12)/p-1/b3-2+