2-[2-[(4-pentoxyphenyl)methylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(4-pentoxyphenyl)methylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[(4-pentoxyphenyl)methylamino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[(4-pentoxyphenyl)methylamino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(4-pentoxyphenyl)methylamino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[(4-amoxybenzyl)amino]thiazol-4-yl]acetic acid Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)CNC2=NC(=CS2)CC(=O)O

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)CNC2=NC(=CS2)CC(=O)O

InChI

InChI=1S/C17H22N2O3S/c1-2-3-4-9-22-15-7-5-13(6-8-15)11-18-17-19-14(12-23-17)10-16(20)21/h5-8,12H,2-4,9-11H2,1H3,(H,18,19)(H,20,21)