4-[(4-ethylphenyl)methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(4-ethylphenyl)methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[(4-ethylphenyl)methylamino]-4-oxo-butanoate CAS Name: 4-[(4-ethylphenyl)methylamino]-4-oxobutanoate IUPAC Name: 4-[(4-ethylphenyl)methylamino]-4-oxobutanoate Traditional Name: 4-[(4-ethylbenzyl)amino]-4-keto-butyrate Formula: C13H16NO3- MolecularWeight: 234.27104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)CCC(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C13H17NO3/c1-2-10-3-5-11(6-4-10)9-14-12(15)7-8-13(16)17/h3-6H,2,7-9H2,1H3,(H,14,15)(H,16,17)/p-1