5-[3-[[1-(3-methoxyphenyl)ethylamino]methyl]phenyl]furan-2-carboxylic acid

Systemtic Name: 5-[3-[[1-(3-methoxyphenyl)ethylamino]methyl]phenyl]furan-2-carboxylic acid Openeye Name: 5-[3-[[1-(3-methoxyphenyl)ethylamino]methyl]phenyl]furan-2-carboxylic acid CAS Name: 5-[3-[[1-(3-methoxyphenyl)ethylamino]methyl]phenyl]-2-furancarboxylic acid IUPAC Name: 5-[3-[[1-(3-methoxyphenyl)ethylamino]methyl]phenyl]furan-2-carboxylic acid Traditional Name: 5-[3-[[1-(3-methoxyphenyl)ethylamino]methyl]phenyl]-2-furoic acid Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OC)NCC2=CC=CC(=C2)C3=CC=C(O3)C(=O)O

Isomeric SMILES

CC(C1=CC(=CC=C1)OC)NCC2=CC=CC(=C2)C3=CC=C(O3)C(=O)O

InChI

InChI=1S/C21H21NO4/c1-14(16-6-4-8-18(12-16)25-2)22-13-15-5-3-7-17(11-15)19-9-10-20(26-19)21(23)24/h3-12,14,22H,13H2,1-2H3,(H,23,24)