4-(aminomethyl)-2-methyl-5-(2-methylpropyl)furan-3-carboxylic acid

Systemtic Name: 4-(aminomethyl)-2-methyl-5-(2-methylpropyl)furan-3-carboxylic acid Openeye Name: 4-(aminomethyl)-5-isobutyl-2-methyl-furan-3-carboxylic acid CAS Name: 4-(aminomethyl)-2-methyl-5-(2-methylpropyl)-3-furancarboxylic acid IUPAC Name: 4-(aminomethyl)-2-methyl-5-(2-methylpropyl)furan-3-carboxylic acid Traditional Name: 4-(aminomethyl)-5-isobutyl-2-methyl-3-furoic acid Formula: C11H17NO3 MolecularWeight: 211.25758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)CC(C)C)CN)C(=O)O

Isomeric SMILES

CC1=C(C(=C(O1)CC(C)C)CN)C(=O)O

InChI

InChI=1S/C11H17NO3/c1-6(2)4-9-8(5-12)10(11(13)14)7(3)15-9/h6H,4-5,12H2,1-3H3,(H,13,14)