4-(9-phenylnon-5-ynylamino)benzoic acid

Systemtic Name: 4-(9-phenylnon-5-ynylamino)benzoic acid Openeye Name: 4-(9-phenylnon-5-ynylamino)benzoic acid CAS Name: 4-(9-phenylnon-5-ynylamino)benzoic acid IUPAC Name: 4-(9-phenylnon-5-ynylamino)benzoic acid Traditional Name: 4-(9-phenylnon-5-ynylamino)benzoic acid Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC#CCCCCNC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCC#CCCCCNC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C22H25NO2/c24-22(25)20-14-16-21(17-15-20)23-18-10-5-3-1-2-4-7-11-19-12-8-6-9-13-19/h6,8-9,12-17,23H,3-5,7,10-11,18H2,(H,24,25)