2-(1,3-benzodioxol-5-ylamino)-5-methyl-hexanoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-ylamino)-5-methyl-hexanoic acid Openeye Name: 2-(1,3-benzodioxol-5-ylamino)-5-methyl-hexanoic acid CAS Name: 2-(1,3-benzodioxol-5-ylamino)-5-methylhexanoic acid IUPAC Name: 2-(1,3-benzodioxol-5-ylamino)-5-methylhexanoic acid Traditional Name: 2-(1,3-benzodioxol-5-ylamino)-5-methyl-hexanoic acid Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(=O)O)NC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)CCC(C(=O)O)NC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H19NO4/c1-9(2)3-5-11(14(16)17)15-10-4-6-12-13(7-10)19-8-18-12/h4,6-7,9,11,15H,3,5,8H2,1-2H3,(H,16,17)