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

Systemtic Name: (E)-3-[4-(octanoylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(octanoylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(1-oxooctylamino)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(octanoylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(caprylylamino)phenyl]acrylic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO3/c1-2-3-4-5-6-7-16(19)18-15-11-8-14(9-12-15)10-13-17(20)21/h8-13H,2-7H2,1H3,(H,18,19)(H,20,21)/b13-10+