2-azanyl-6-[[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]amino]hexanoic acid

Systemtic Name: 2-azanyl-6-[[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 2-amino-6-[[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]amino]hexanoic acid CAS Name: 2-amino-6-[[(E)-3-(1H-imidazol-5-yl)-1-oxoprop-2-enyl]amino]hexanoic acid IUPAC Name: 2-amino-6-[[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 2-amino-6-[[(E)-3-(1H-imidazol-5-yl)acryloyl]amino]hexanoic acid Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)C=CC(=O)NCCCCC(C(=O)O)N

Isomeric SMILES

C1=C(NC=N1)/C=C/C(=O)NCCCCC(C(=O)O)N

InChI

InChI=1S/C12H18N4O3/c13-10(12(18)19)3-1-2-6-15-11(17)5-4-9-7-14-8-16-9/h4-5,7-8,10H,1-3,6,13H2,(H,14,16)(H,15,17)(H,18,19)/b5-4+