2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]hexanoic acid

Systemtic Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]hexanoic acid CAS Name: 2-[[(E)-3-(4-cyanophenyl)-1-oxoprop-2-enyl]amino]hexanoic acid IUPAC Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 2-[[(E)-3-(4-cyanophenyl)acryloyl]amino]hexanoic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C=CC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)/C=C/C1=CC=C(C=C1)C#N

InChI

InChI=1S/C16H18N2O3/c1-2-3-4-14(16(20)21)18-15(19)10-9-12-5-7-13(11-17)8-6-12/h5-10,14H,2-4H2,1H3,(H,18,19)(H,20,21)/b10-9+