2-(1,2-benzoxazol-3-ylamino)-4,4-dimethyl-hexanoic acid

Systemtic Name: 2-(1,2-benzoxazol-3-ylamino)-4,4-dimethyl-hexanoic acid Openeye Name: 2-(1,2-benzoxazol-3-ylamino)-4,4-dimethyl-hexanoic acid CAS Name: 2-(1,2-benzoxazol-3-ylamino)-4,4-dimethylhexanoic acid IUPAC Name: 2-(1,2-benzoxazol-3-ylamino)-4,4-dimethylhexanoic acid Traditional Name: 2-(indoxazen-3-ylamino)-4,4-dimethyl-hexanoic acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)CC(C(=O)O)NC1=NOC2=CC=CC=C21

Isomeric SMILES

CCC(C)(C)CC(C(=O)O)NC1=NOC2=CC=CC=C21

InChI

InChI=1S/C15H20N2O3/c1-4-15(2,3)9-11(14(18)19)16-13-10-7-5-6-8-12(10)20-17-13/h5-8,11H,4,9H2,1-3H3,(H,16,17)(H,18,19)