5-[(4-butan-2-ylphenyl)amino]pentanoic acid

Systemtic Name: 5-[(4-butan-2-ylphenyl)amino]pentanoic acid Openeye Name: 5-(4-sec-butylanilino)pentanoic acid CAS Name: 5-(4-butan-2-ylanilino)pentanoic acid IUPAC Name: 5-(4-butan-2-ylanilino)pentanoic acid Traditional Name: 5-(4-sec-butylanilino)valeric acid Formula: C15H23NO2 MolecularWeight: 249.34862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO2/c1-3-12(2)13-7-9-14(10-8-13)16-11-5-4-6-15(17)18/h7-10,12,16H,3-6,11H2,1-2H3,(H,17,18)