(E)-3-[4-[[(2R)-2-azanylbutanoyl]amino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[[(2R)-2-azanylbutanoyl]amino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[[(2R)-2-aminobutanoyl]amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[(2R)-2-amino-1-oxobutyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[[(2R)-2-aminobutanoyl]amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[[(2R)-2-aminobutanoyl]amino]phenyl]acrylic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C=CC(=O)O)N

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=C(C=C1)/C=C/C(=O)O)N

InChI

InChI=1S/C13H16N2O3/c1-2-11(14)13(18)15-10-6-3-9(4-7-10)5-8-12(16)17/h3-8,11H,2,14H2,1H3,(H,15,18)(H,16,17)/b8-5+/t11-/m1/s1