6-azanyl-2-[[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 6-amino-2-[[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]amino]hexanoic acid CAS Name: 6-amino-2-[[(E)-3-(3,5-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[(E)-3-(3,5-dimethoxyphenyl)acryloyl]amino]hexanoic acid Formula: C17H24N2O5 MolecularWeight: 336.38286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=CC(=O)NC(CCCCN)C(=O)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C/C(=O)NC(CCCCN)C(=O)O)OC

InChI

InChI=1S/C17H24N2O5/c1-23-13-9-12(10-14(11-13)24-2)6-7-16(20)19-15(17(21)22)5-3-4-8-18/h6-7,9-11,15H,3-5,8,18H2,1-2H3,(H,19,20)(H,21,22)/b7-6+