4-(3-imidazol-1-ylpropylamino)-3-methyl-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-(3-imidazol-1-ylpropylamino)-3-methyl-4-oxidanylidene-but-2-enoate Openeye Name: 4-(3-imidazol-1-ylpropylamino)-3-methyl-4-oxo-but-2-enoate CAS Name: 4-[3-(1-imidazolyl)propylamino]-3-methyl-4-oxo-2-butenoate IUPAC Name: 4-(3-imidazol-1-ylpropylamino)-3-methyl-4-oxobut-2-enoate Traditional Name: 4-(3-imidazol-1-ylpropylamino)-4-keto-3-methyl-but-2-enoate Formula: C11H14N3O3- MolecularWeight: 236.24716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)[O-])C(=O)NCCCN1C=CN=C1

Isomeric SMILES

CC(=CC(=O)[O-])C(=O)NCCCN1C=CN=C1

InChI

InChI=1S/C11H15N3O3/c1-9(7-10(15)16)11(17)13-3-2-5-14-6-4-12-8-14/h4,6-8H,2-3,5H2,1H3,(H,13,17)(H,15,16)/p-1