3-[4-(cyclopentylmethylamino)phenyl]prop-2-ynoic acid

Systemtic Name: 3-[4-(cyclopentylmethylamino)phenyl]prop-2-ynoic acid Openeye Name: 3-[4-(cyclopentylmethylamino)phenyl]prop-2-ynoic acid CAS Name: 3-[4-(cyclopentylmethylamino)phenyl]-2-propynoic acid IUPAC Name: 3-[4-(cyclopentylmethylamino)phenyl]prop-2-ynoic acid Traditional Name: 3-[4-(cyclopentylmethylamino)phenyl]propiolic acid Formula: C15H17NO2 MolecularWeight: 243.30098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CNC2=CC=C(C=C2)C#CC(=O)O

Isomeric SMILES

C1CCC(C1)CNC2=CC=C(C=C2)C#CC(=O)O

InChI

InChI=1S/C15H17NO2/c17-15(18)10-7-12-5-8-14(9-6-12)16-11-13-3-1-2-4-13/h5-6,8-9,13,16H,1-4,11H2,(H,17,18)