(E)-4-[(2-methylphenyl)methyl-propyl-amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(2-methylphenyl)methyl-propyl-amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[o-tolylmethyl(propyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(2-methylphenyl)methyl-propylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(2-methylphenyl)methyl-propylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[(2-methylbenzyl)-propyl-amino]but-2-enoic acid Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1C)C(=O)C=CC(=O)O

Isomeric SMILES

CCCN(CC1=CC=CC=C1C)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C15H19NO3/c1-3-10-16(14(17)8-9-15(18)19)11-13-7-5-4-6-12(13)2/h4-9H,3,10-11H2,1-2H3,(H,18,19)/b9-8+