6-azanyl-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 6-amino-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]hexanoic acid CAS Name: 6-amino-2-[[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[(E)-3-(3,4-dimethoxyphenyl)acryloyl]amino]hexanoic acid Formula: C17H24N2O5 MolecularWeight: 336.38286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O5/c1-23-14-8-6-12(11-15(14)24-2)7-9-16(20)19-13(17(21)22)5-3-4-10-18/h6-9,11,13H,3-5,10,18H2,1-2H3,(H,19,20)(H,21,22)/b9-7+