tert-butyl (E)-3-[4-[[[3-[(E)-3-azanyl-3-oxidanylidene-prop-1-enyl]phenyl]-cyclohexylcarbonyl-amino]methyl]phenyl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[4-[[[3-[(E)-3-azanyl-3-oxidanylidene-prop-1-enyl]phenyl]-cyclohexylcarbonyl-amino]methyl]phenyl]prop-2-enoate Openeye Name: tert-butyl (E)-3-[4-[[3-[(E)-3-amino-3-oxo-prop-1-enyl]-N-(cyclohexanecarbonyl)anilino]methyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[3-[(E)-3-amino-3-oxoprop-1-enyl]-N-[cyclohexyl(oxo)methyl]anilino]methyl]phenyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-[4-[[3-[(E)-3-amino-3-oxoprop-1-enyl]-N-(cyclohexanecarbonyl)anilino]methyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[[3-[(E)-3-amino-3-keto-prop-1-enyl]-N-(cyclohexanecarbonyl)anilino]methyl]phenyl]acrylic acid tert-butyl ester Formula: C30H36N2O4 MolecularWeight: 488.61784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=CC=C(C=C1)CN(C2=CC=CC(=C2)C=CC(=O)N)C(=O)C3CCCCC3

Isomeric SMILES

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

InChI

InChI=1S/C30H36N2O4/c1-30(2,3)36-28(34)19-17-22-12-14-24(15-13-22)21-32(29(35)25-9-5-4-6-10-25)26-11-7-8-23(20-26)16-18-27(31)33/h7-8,11-20,25H,4-6,9-10,21H2,1-3H3,(H2,31,33)/b18-16+,19-17+