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butanoyl 4-(hexadecylamino)benzoate

butanoyl 4-(hexadecylamino)benzoate

Systemtic Name:butanoyl 4-(hexadecylamino)benzoate
Openeye Name:butanoyl 4-(hexadecylamino)benzoate
CAS Name:4-(hexadecylamino)benzoic acid 1-oxobutyl ester
IUPAC Name:butanoyl 4-(hexadecylamino)benzoate
Traditional Name:4-(cetylamino)benzoic acid butyryl ester
Formula: C27H45NO3
MolecularWeight: 431.6511
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(=O)CCC


Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(=O)CCC


InChI

InChI=1S/C27H45NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-23-28-25-21-19-24(20-22-25)27(30)31-26(29)18-4-2/h19-22,28H,3-18,23H2,1-2H3


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