ethyl 2-[(2-ethoxy-2-oxidanylidene-ethyl)-[(E)-3-(2-octadecan-3-yloxyphenyl)prop-2-enoyl]amino]ethanoate

Systemtic Name: ethyl 2-[(2-ethoxy-2-oxidanylidene-ethyl)-[(E)-3-(2-octadecan-3-yloxyphenyl)prop-2-enoyl]amino]ethanoate Openeye Name: ethyl 2-[(2-ethoxy-2-oxo-ethyl)-[(E)-3-[2-(1-ethylhexadecoxy)phenyl]prop-2-enoyl]amino]acetate CAS Name: 2-[(2-ethoxy-2-oxoethyl)-[(E)-3-(2-octadecan-3-yloxyphenyl)-1-oxoprop-2-enyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2-ethoxy-2-oxoethyl)-[(E)-3-(2-octadecan-3-yloxyphenyl)prop-2-enoyl]amino]acetate Traditional Name: 2-[(2-ethoxy-2-keto-ethyl)-[(E)-3-[2-(1-ethylhexadecoxy)phenyl]acryloyl]amino]acetic acid ethyl ester Formula: C35H57NO6 MolecularWeight: 587.83018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC)OC1=CC=CC=C1C=CC(=O)N(CC(=O)OCC)CC(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(CC)OC1=CC=CC=C1/C=C/C(=O)N(CC(=O)OCC)CC(=O)OCC

InChI

InChI=1S/C35H57NO6/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-24-31(6-2)42-32-25-22-21-23-30(32)26-27-33(37)36(28-34(38)40-7-3)29-35(39)41-8-4/h21-23,25-27,31H,5-20,24,28-29H2,1-4H3/b27-26+