4-[(4-ethylphenyl)methyl-prop-2-enyl-amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-ethylphenyl)methyl-prop-2-enyl-amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[allyl-[(4-ethylphenyl)methyl]amino]-4-oxo-butanoic acid CAS Name: 4-[(4-ethylphenyl)methyl-prop-2-enylamino]-4-oxobutanoic acid IUPAC Name: 4-[(4-ethylphenyl)methyl-prop-2-enylamino]-4-oxobutanoic acid Traditional Name: 4-[allyl-(4-ethylbenzyl)amino]-4-keto-butyric acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(CC=C)C(=O)CCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN(CC=C)C(=O)CCC(=O)O

InChI

InChI=1S/C16H21NO3/c1-3-11-17(15(18)9-10-16(19)20)12-14-7-5-13(4-2)6-8-14/h3,5-8H,1,4,9-12H2,2H3,(H,19,20)