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5-[3-[(pentylamino)methyl]phenyl]-1,2-oxazole-3-carboxylic acid

5-[3-[(pentylamino)methyl]phenyl]-1,2-oxazole-3-carboxylic acid

Systemtic Name:5-[3-[(pentylamino)methyl]phenyl]-1,2-oxazole-3-carboxylic acid
Openeye Name:5-[3-[(pentylamino)methyl]phenyl]isoxazole-3-carboxylic acid
CAS Name:5-[3-[(pentylamino)methyl]phenyl]-3-isoxazolecarboxylic acid
IUPAC Name:5-[3-[(pentylamino)methyl]phenyl]-1,2-oxazole-3-carboxylic acid
Traditional Name:5-[3-[(amylamino)methyl]phenyl]isoxazole-3-carboxylic acid
Formula: C16H20N2O3
MolecularWeight: 288.3416
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1=CC=CC(=C1)C2=CC(=NO2)C(=O)O


Isomeric SMILES

CCCCCNCC1=CC=CC(=C1)C2=CC(=NO2)C(=O)O


InChI

InChI=1S/C16H20N2O3/c1-2-3-4-8-17-11-12-6-5-7-13(9-12)15-10-14(16(19)20)18-21-15/h5-7,9-10,17H,2-4,8,11H2,1H3,(H,19,20)


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