(E)-4-(cyclobutylmethylamino)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(cyclobutylmethylamino)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(cyclobutylmethylamino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(cyclobutylmethylamino)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(cyclobutylmethylamino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(cyclobutylmethylamino)-4-keto-but-2-enoic acid Formula: C9H13NO3 MolecularWeight: 183.20442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CNC(=O)C=CC(=O)O

Isomeric SMILES

C1CC(C1)CNC(=O)/C=C/C(=O)O

InChI

InChI=1S/C9H13NO3/c11-8(4-5-9(12)13)10-6-7-2-1-3-7/h4-5,7H,1-3,6H2,(H,10,11)(H,12,13)/b5-4+