5-[(4-butylphenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(4-butylphenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(4-butylanilino)-5-oxo-pentanoic acid CAS Name: 5-(4-butylanilino)-5-oxopentanoic acid IUPAC Name: 5-(4-butylanilino)-5-oxopentanoic acid Traditional Name: 5-(4-butylanilino)-5-keto-valeric acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCCC(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCCC(=O)O

InChI

InChI=1S/C15H21NO3/c1-2-3-5-12-8-10-13(11-9-12)16-14(17)6-4-7-15(18)19/h8-11H,2-7H2,1H3,(H,16,17)(H,18,19)