hexyl 4-[[(E)-3-(3-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: hexyl 4-[[(E)-3-(3-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: hexyl 4-[[(E)-3-(4-isopropoxy-3-methoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(3-methoxy-4-propan-2-yloxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[(E)-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(4-isopropoxy-3-methoxy-phenyl)acryloyl]amino]benzoic acid hexyl ester Formula: C26H33NO5 MolecularWeight: 439.54392

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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)OC(C)C)OC

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CC(=C(C=C2)OC(C)C)OC

InChI

InChI=1S/C26H33NO5/c1-5-6-7-8-17-31-26(29)21-11-13-22(14-12-21)27-25(28)16-10-20-9-15-23(32-19(2)3)24(18-20)30-4/h9-16,18-19H,5-8,17H2,1-4H3,(H,27,28)/b16-10+