methyl (E)-4-oxidanylidene-4-(propylamino)but-2-enoate

Systemtic Name: methyl (E)-4-oxidanylidene-4-(propylamino)but-2-enoate Openeye Name: methyl (E)-4-oxo-4-(propylamino)but-2-enoate CAS Name: (E)-4-oxo-4-(propylamino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-oxo-4-(propylamino)but-2-enoate Traditional Name: (E)-4-keto-4-(propylamino)but-2-enoic acid methyl ester Formula: C8H13NO3 MolecularWeight: 171.19372

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C=CC(=O)OC

Isomeric SMILES

CCCNC(=O)/C=C/C(=O)OC

InChI

InChI=1S/C8H13NO3/c1-3-6-9-7(10)4-5-8(11)12-2/h4-5H,3,6H2,1-2H3,(H,9,10)/b5-4+