N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methyl-phenyl]-4-methyl-pentanamide

Systemtic Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methyl-phenyl]-4-methyl-pentanamide Openeye Name: N-[5-[5-(hydroxymethyl)-2-furyl]-2-methyl-phenyl]-4-methyl-pentanamide CAS Name: N-[5-[5-(hydroxymethyl)-2-furanyl]-2-methylphenyl]-4-methylpentanamide IUPAC Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methylphenyl]-4-methylpentanamide Traditional Name: 4-methyl-N-[2-methyl-5-(5-methylol-2-furyl)phenyl]valeramide Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)CCC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)CCC(C)C

InChI

InChI=1S/C18H23NO3/c1-12(2)4-9-18(21)19-16-10-14(6-5-13(16)3)17-8-7-15(11-20)22-17/h5-8,10,12,20H,4,9,11H2,1-3H3,(H,19,21)