methyl 4-[5-[(pentylamino)methyl]furan-2-yl]benzoate

Systemtic Name: methyl 4-[5-[(pentylamino)methyl]furan-2-yl]benzoate Openeye Name: methyl 4-[5-[(pentylamino)methyl]-2-furyl]benzoate CAS Name: 4-[5-[(pentylamino)methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-[(pentylamino)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(amylamino)methyl]-2-furyl]benzoic acid methyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1=CC=C(O1)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCCNCC1=CC=C(O1)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H23NO3/c1-3-4-5-12-19-13-16-10-11-17(22-16)14-6-8-15(9-7-14)18(20)21-2/h6-11,19H,3-5,12-13H2,1-2H3