2-(butylamino)-3-(cyclopenten-1-yl)benzoic acid

Systemtic Name: 2-(butylamino)-3-(cyclopenten-1-yl)benzoic acid Openeye Name: 2-(butylamino)-3-(cyclopenten-1-yl)benzoic acid CAS Name: 2-(butylamino)-3-(1-cyclopentenyl)benzoic acid IUPAC Name: 2-(butylamino)-3-(cyclopenten-1-yl)benzoic acid Traditional Name: 2-(butylamino)-3-(cyclopenten-1-yl)benzoic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=CC=C1C(=O)O)C2=CCCC2

Isomeric SMILES

CCCCNC1=C(C=CC=C1C(=O)O)C2=CCCC2

InChI

InChI=1S/C16H21NO2/c1-2-3-11-17-15-13(12-7-4-5-8-12)9-6-10-14(15)16(18)19/h6-7,9-10,17H,2-5,8,11H2,1H3,(H,18,19)