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

Systemtic Name: methyl (E)-3-[3-[cyclohexylcarbonyl(naphthalen-2-ylmethyl)amino]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-[cyclohexanecarbonyl(2-naphthylmethyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[3-[[cyclohexyl(oxo)methyl]-(2-naphthalenylmethyl)amino]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-[cyclohexanecarbonyl(naphthalen-2-ylmethyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-[cyclohexanecarbonyl(2-naphthylmethyl)amino]phenyl]acrylic acid methyl ester Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC(=CC=C1)N(CC2=CC3=CC=CC=C3C=C2)C(=O)C4CCCCC4

Isomeric SMILES

COC(=O)/C=C/C1=CC(=CC=C1)N(CC2=CC3=CC=CC=C3C=C2)C(=O)C4CCCCC4

InChI

InChI=1S/C28H29NO3/c1-32-27(30)17-15-21-8-7-13-26(19-21)29(28(31)24-10-3-2-4-11-24)20-22-14-16-23-9-5-6-12-25(23)18-22/h5-9,12-19,24H,2-4,10-11,20H2,1H3/b17-15+