3-[(2-methylfuran-3-yl)carbonyl-(phenylmethyl)amino]propanoic acid

Systemtic Name: 3-[(2-methylfuran-3-yl)carbonyl-(phenylmethyl)amino]propanoic acid Openeye Name: 3-[benzyl-(2-methylfuran-3-carbonyl)amino]propanoic acid CAS Name: 3-[[(2-methyl-3-furanyl)-oxomethyl]-(phenylmethyl)amino]propanoic acid IUPAC Name: 3-[benzyl-(2-methylfuran-3-carbonyl)amino]propanoic acid Traditional Name: 3-[benzyl-(2-methyl-3-furoyl)amino]propionic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)N(CCC(=O)O)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CO1)C(=O)N(CCC(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C16H17NO4/c1-12-14(8-10-21-12)16(20)17(9-7-15(18)19)11-13-5-3-2-4-6-13/h2-6,8,10H,7,9,11H2,1H3,(H,18,19)