4-methyl-3-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzoic acid

Systemtic Name: 4-methyl-3-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzoic acid Openeye Name: 4-methyl-3-[[5-(2-methylcyclopropyl)-2-furyl]methylamino]benzoic acid CAS Name: 4-methyl-3-[[5-(2-methylcyclopropyl)-2-furanyl]methylamino]benzoic acid IUPAC Name: 4-methyl-3-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzoic acid Traditional Name: 4-methyl-3-[[5-(2-methylcyclopropyl)-2-furyl]methylamino]benzoic acid Formula: C17H19NO3 MolecularWeight: 285.33766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C2=CC=C(O2)CNC3=C(C=CC(=C3)C(=O)O)C

Isomeric SMILES

CC1CC1C2=CC=C(O2)CNC3=C(C=CC(=C3)C(=O)O)C

InChI

InChI=1S/C17H19NO3/c1-10-3-4-12(17(19)20)8-15(10)18-9-13-5-6-16(21-13)14-7-11(14)2/h3-6,8,11,14,18H,7,9H2,1-2H3,(H,19,20)