5-[(3-propan-2-ylphenyl)amino]pentanoic acid

Systemtic Name: 5-[(3-propan-2-ylphenyl)amino]pentanoic acid Openeye Name: 5-(3-isopropylanilino)pentanoic acid CAS Name: 5-(3-propan-2-ylanilino)pentanoic acid IUPAC Name: 5-(3-propan-2-ylanilino)pentanoic acid Traditional Name: 5-(3-isopropylanilino)valeric acid Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NCCCCC(=O)O

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NCCCCC(=O)O

InChI

InChI=1S/C14H21NO2/c1-11(2)12-6-5-7-13(10-12)15-9-4-3-8-14(16)17/h5-7,10-11,15H,3-4,8-9H2,1-2H3,(H,16,17)