cyclohexyl 4-[[(E)-3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: cyclohexyl 4-[[(E)-3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: cyclohexyl 4-[[(E)-3-(4-benzyloxy-3-bromo-5-methoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[[(E)-3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(4-benzoxy-3-bromo-5-methoxy-phenyl)acryloyl]amino]benzoic acid cyclohexyl ester Formula: C30H30BrNO5 MolecularWeight: 564.4669

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)NC2=CC=C(C=C2)C(=O)OC3CCCCC3)Br)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)OC3CCCCC3)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C30H30BrNO5/c1-35-27-19-22(18-26(31)29(27)36-20-21-8-4-2-5-9-21)12-17-28(33)32-24-15-13-23(14-16-24)30(34)37-25-10-6-3-7-11-25/h2,4-5,8-9,12-19,25H,3,6-7,10-11,20H2,1H3,(H,32,33)/b17-12+