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

Systemtic Name: (E)-3-[4-(heptanoylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(heptanoylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(1-oxoheptylamino)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(heptanoylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(enanthylamino)phenyl]acrylic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-2-3-4-5-6-15(18)17-14-10-7-13(8-11-14)9-12-16(19)20/h7-12H,2-6H2,1H3,(H,17,18)(H,19,20)/b12-9+