methyl (E)-3-[3-[cyclohexylcarbonyl(naphthalen-2-yl)amino]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-[cyclohexylcarbonyl(naphthalen-2-yl)amino]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-[cyclohexanecarbonyl(2-naphthyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[3-[[cyclohexyl(oxo)methyl]-(2-naphthalenyl)amino]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-[cyclohexanecarbonyl(naphthalen-2-yl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-[cyclohexanecarbonyl(2-naphthyl)amino]phenyl]acrylic acid methyl ester Formula: C27H27NO3 MolecularWeight: 413.50818

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC(=CC=C1)N(C2=CC3=CC=CC=C3C=C2)C(=O)C4CCCCC4

Isomeric SMILES

COC(=O)/C=C/C1=CC(=CC=C1)N(C2=CC3=CC=CC=C3C=C2)C(=O)C4CCCCC4

InChI

InChI=1S/C27H27NO3/c1-31-26(29)17-14-20-8-7-13-24(18-20)28(27(30)22-10-3-2-4-11-22)25-16-15-21-9-5-6-12-23(21)19-25/h5-9,12-19,22H,2-4,10-11H2,1H3/b17-14+