methyl (E)-3-[3-[(4-tert-butylphenyl)methyl-cyclohexylcarbonyl-amino]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-[(4-tert-butylphenyl)methyl-cyclohexylcarbonyl-amino]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-[(4-tert-butylphenyl)methyl-(cyclohexanecarbonyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[3-[(4-tert-butylphenyl)methyl-[cyclohexyl(oxo)methyl]amino]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-[(4-tert-butylphenyl)methyl-(cyclohexanecarbonyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-[(4-tert-butylbenzyl)-(cyclohexanecarbonyl)amino]phenyl]acrylic acid methyl ester Formula: C28H35NO3 MolecularWeight: 433.5824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(C2=CC=CC(=C2)C=CC(=O)OC)C(=O)C3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(C2=CC=CC(=C2)/C=C/C(=O)OC)C(=O)C3CCCCC3

InChI

InChI=1S/C28H35NO3/c1-28(2,3)24-16-13-22(14-17-24)20-29(27(31)23-10-6-5-7-11-23)25-12-8-9-21(19-25)15-18-26(30)32-4/h8-9,12-19,23H,5-7,10-11,20H2,1-4H3/b18-15+