dodecyl (2S)-3-[3,4-bis(oxidanyl)phenyl]-2-[[(E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]propanoate

Systemtic Name: dodecyl (2S)-3-[3,4-bis(oxidanyl)phenyl]-2-[[(E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]propanoate Openeye Name: dodecyl (2S)-3-(3,4-dihydroxyphenyl)-2-[[(E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoyl]amino]propanoate CAS Name: (2S)-3-(3,4-dihydroxyphenyl)-2-[[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]propanoic acid dodecyl ester IUPAC Name: dodecyl (2S)-3-(3,4-dihydroxyphenyl)-2-[[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]amino]propanoate Traditional Name: (2S)-3-(3,4-dihydroxyphenyl)-2-[[(E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)acryloyl]amino]propionic acid lauryl ester Formula: C32H45NO8 MolecularWeight: 571.7016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(CC1=CC(=C(C=C1)O)O)NC(=O)C=CC2=CC(=C(C(=C2)OC)O)OC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)[C@H](CC1=CC(=C(C=C1)O)O)NC(=O)/C=C/C2=CC(=C(C(=C2)OC)O)OC

InChI

InChI=1S/C32H45NO8/c1-4-5-6-7-8-9-10-11-12-13-18-41-32(38)25(19-23-14-16-26(34)27(35)20-23)33-30(36)17-15-24-21-28(39-2)31(37)29(22-24)40-3/h14-17,20-22,25,34-35,37H,4-13,18-19H2,1-3H3,(H,33,36)/b17-15+/t25-/m0/s1