5-[[(3-methoxyphenyl)methyl-propan-2-yl-amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[(3-methoxyphenyl)methyl-propan-2-yl-amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[[isopropyl-[(3-methoxyphenyl)methyl]amino]methyl]furan-2-carboxylic acid CAS Name: 5-[[(3-methoxyphenyl)methyl-propan-2-ylamino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[(3-methoxyphenyl)methyl-propan-2-ylamino]methyl]furan-2-carboxylic acid Traditional Name: 5-[[isopropyl(m-anisyl)amino]methyl]-2-furoic acid Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC(=CC=C1)OC)CC2=CC=C(O2)C(=O)O

Isomeric SMILES

CC(C)N(CC1=CC(=CC=C1)OC)CC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C17H21NO4/c1-12(2)18(10-13-5-4-6-14(9-13)21-3)11-15-7-8-16(22-15)17(19)20/h4-9,12H,10-11H2,1-3H3,(H,19,20)