ethyl 4-(7-phenylhept-3-ynylamino)benzoate

Systemtic Name: ethyl 4-(7-phenylhept-3-ynylamino)benzoate Openeye Name: ethyl 4-(7-phenylhept-3-ynylamino)benzoate CAS Name: 4-(7-phenylhept-3-ynylamino)benzoic acid ethyl ester IUPAC Name: ethyl 4-(7-phenylhept-3-ynylamino)benzoate Traditional Name: 4-(7-phenylhept-3-ynylamino)benzoic acid ethyl ester Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCCC#CCCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCCC#CCCCC2=CC=CC=C2

InChI

InChI=1S/C22H25NO2/c1-2-25-22(24)20-14-16-21(17-15-20)23-18-10-5-3-4-7-11-19-12-8-6-9-13-19/h6,8-9,12-17,23H,2,4,7,10-11,18H2,1H3