N-[[5-methyl-3-(4-propylphenyl)-1-benzofuran-2-yl]methyl]heptan-1-amine

Systemtic Name: N-[[5-methyl-3-(4-propylphenyl)-1-benzofuran-2-yl]methyl]heptan-1-amine Openeye Name: N-[[5-methyl-3-(4-propylphenyl)benzofuran-2-yl]methyl]heptan-1-amine CAS Name: N-[[5-methyl-3-(4-propylphenyl)-2-benzofuranyl]methyl]-1-heptanamine IUPAC Name: N-[[5-methyl-3-(4-propylphenyl)-1-benzofuran-2-yl]methyl]heptan-1-amine Traditional Name: heptyl-[[5-methyl-3-(4-propylphenyl)benzofuran-2-yl]methyl]amine Formula: C26H35NO MolecularWeight: 377.5622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCC1=C(C2=C(O1)C=CC(=C2)C)C3=CC=C(C=C3)CCC

Isomeric SMILES

CCCCCCCNCC1=C(C2=C(O1)C=CC(=C2)C)C3=CC=C(C=C3)CCC

InChI

InChI=1S/C26H35NO/c1-4-6-7-8-9-17-27-19-25-26(22-14-12-21(10-5-2)13-15-22)23-18-20(3)11-16-24(23)28-25/h11-16,18,27H,4-10,17,19H2,1-3H3