hexyl 4-[[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: hexyl 4-[[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: hexyl 4-[[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(4-butoxy-3-ethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[(E)-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(4-butoxy-3-ethoxy-phenyl)acryloyl]amino]benzoic acid hexyl ester Formula: C28H37NO5 MolecularWeight: 467.59708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C=C2)OCCCC)OCC

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CC(=C(C=C2)OCCCC)OCC

InChI

InChI=1S/C28H37NO5/c1-4-7-9-10-20-34-28(31)23-13-15-24(16-14-23)29-27(30)18-12-22-11-17-25(33-19-8-5-2)26(21-22)32-6-3/h11-18,21H,4-10,19-20H2,1-3H3,(H,29,30)/b18-12+