methyl 4-[(5-bromanylfuran-2-yl)methylamino]-3-methyl-benzoate

Systemtic Name: methyl 4-[(5-bromanylfuran-2-yl)methylamino]-3-methyl-benzoate Openeye Name: methyl 4-[(5-bromo-2-furyl)methylamino]-3-methyl-benzoate CAS Name: 4-[(5-bromo-2-furanyl)methylamino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[(5-bromofuran-2-yl)methylamino]-3-methylbenzoate Traditional Name: 4-[(5-bromo-2-furyl)methylamino]-3-methyl-benzoic acid methyl ester Formula: C14H14BrNO3 MolecularWeight: 324.16986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NCC2=CC=C(O2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NCC2=CC=C(O2)Br

InChI

InChI=1S/C14H14BrNO3/c1-9-7-10(14(17)18-2)3-5-12(9)16-8-11-4-6-13(15)19-11/h3-7,16H,8H2,1-2H3