3-(furan-2-ylmethylamino)-4-methyl-benzoate

Systemtic Name: 3-(furan-2-ylmethylamino)-4-methyl-benzoate Openeye Name: 3-(2-furylmethylamino)-4-methyl-benzoate CAS Name: 3-(2-furanylmethylamino)-4-methylbenzoate IUPAC Name: 3-(furan-2-ylmethylamino)-4-methylbenzoate Traditional Name: 3-(2-furfurylamino)-4-methyl-benzoate Formula: C13H12NO3- MolecularWeight: 230.23928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NCC2=CC=CO2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NCC2=CC=CO2

InChI

InChI=1S/C13H13NO3/c1-9-4-5-10(13(15)16)7-12(9)14-8-11-3-2-6-17-11/h2-7,14H,8H2,1H3,(H,15,16)/p-1