4-[[(2S)-butan-2-yl]-[(4-chlorophenyl)methyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[(2S)-butan-2-yl]-[(4-chlorophenyl)methyl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(4-chlorophenyl)methyl-[(1S)-1-methylpropyl]amino]-4-oxo-butanoate CAS Name: 4-[[(2S)-butan-2-yl]-[(4-chlorophenyl)methyl]amino]-4-oxobutanoate IUPAC Name: 4-[[(2S)-butan-2-yl]-[(4-chlorophenyl)methyl]amino]-4-oxobutanoate Traditional Name: 4-[(4-chlorobenzyl)-[(1S)-1-methylpropyl]amino]-4-keto-butyrate Formula: C15H19ClNO3- MolecularWeight: 296.76926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)Cl)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC[C@H](C)N(CC1=CC=C(C=C1)Cl)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C15H20ClNO3/c1-3-11(2)17(14(18)8-9-15(19)20)10-12-4-6-13(16)7-5-12/h4-7,11H,3,8-10H2,1-2H3,(H,19,20)/p-1/t11-/m0/s1