methyl (3S)-5-methyl-3-(2-methylprop-2-enoylamino)-4-oxidanylidene-hex-5-enoate

Systemtic Name: methyl (3S)-5-methyl-3-(2-methylprop-2-enoylamino)-4-oxidanylidene-hex-5-enoate Openeye Name: methyl (3S)-5-methyl-3-(2-methylprop-2-enoylamino)-4-oxo-hex-5-enoate CAS Name: (3S)-5-methyl-3-[(2-methyl-1-oxoprop-2-enyl)amino]-4-oxo-5-hexenoic acid methyl ester IUPAC Name: methyl (3S)-5-methyl-3-(2-methylprop-2-enoylamino)-4-oxohex-5-enoate Traditional Name: (3S)-4-keto-3-methacrylamido-5-methyl-hex-5-enoic acid methyl ester Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)C(CC(=O)OC)NC(=O)C(=C)C

Isomeric SMILES

CC(=C)C(=O)[C@H](CC(=O)OC)NC(=O)C(=C)C

InChI

InChI=1S/C12H17NO4/c1-7(2)11(15)9(6-10(14)17-5)13-12(16)8(3)4/h9H,1,3,6H2,2,4-5H3,(H,13,16)/t9-/m0/s1