1-cyanopropyl 4-(pentadecylamino)benzoate

Systemtic Name: 1-cyanopropyl 4-(pentadecylamino)benzoate Openeye Name: 1-cyanopropyl 4-(pentadecylamino)benzoate CAS Name: 4-(pentadecylamino)benzoic acid 1-cyanopropyl ester IUPAC Name: 1-cyanopropyl 4-(pentadecylamino)benzoate Traditional Name: 4-(pentadecylamino)benzoic acid 1-cyanopropyl ester Formula: C26H42N2O2 MolecularWeight: 414.62388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(CC)C#N

Isomeric SMILES

CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(CC)C#N

InChI

InChI=1S/C26H42N2O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-21-28-24-19-17-23(18-20-24)26(29)30-25(4-2)22-27/h17-20,25,28H,3-16,21H2,1-2H3