(E)-3-[4-(4-methylpentanoylamino)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(4-methylpentanoylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(4-methylpentanoylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[(4-methyl-1-oxopentyl)amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(4-methylpentanoylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(4-methylpentanoylamino)phenyl]acrylic acid Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3/c1-11(2)3-9-14(17)16-13-7-4-12(5-8-13)6-10-15(18)19/h4-8,10-11H,3,9H2,1-2H3,(H,16,17)(H,18,19)/b10-6+