(2S)-2-(4-butoxyphenyl)-4-(methylamino)-4-oxidanylidene-butanoate

Systemtic Name: (2S)-2-(4-butoxyphenyl)-4-(methylamino)-4-oxidanylidene-butanoate Openeye Name: (2S)-2-(4-butoxyphenyl)-4-(methylamino)-4-oxo-butanoate CAS Name: (2S)-2-(4-butoxyphenyl)-4-(methylamino)-4-oxobutanoate IUPAC Name: (2S)-2-(4-butoxyphenyl)-4-(methylamino)-4-oxobutanoate Traditional Name: (2S)-2-(4-butoxyphenyl)-4-keto-4-(methylamino)butyrate Formula: C15H20NO4- MolecularWeight: 278.3236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(CC(=O)NC)C(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@H](CC(=O)NC)C(=O)[O-]

InChI

InChI=1S/C15H21NO4/c1-3-4-9-20-12-7-5-11(6-8-12)13(15(18)19)10-14(17)16-2/h5-8,13H,3-4,9-10H2,1-2H3,(H,16,17)(H,18,19)/p-1/t13-/m0/s1