(E)-4-[(4-ethylphenyl)methyl-prop-2-enyl-amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(4-ethylphenyl)methyl-prop-2-enyl-amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[allyl-[(4-ethylphenyl)methyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(4-ethylphenyl)methyl-prop-2-enylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(4-ethylphenyl)methyl-prop-2-enylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[allyl-(4-ethylbenzyl)amino]-4-keto-but-2-enoic acid Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO3/c1-3-11-17(15(18)9-10-16(19)20)12-14-7-5-13(4-2)6-8-14/h3,5-10H,1,4,11-12H2,2H3,(H,19,20)/b10-9+