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ethyl 4-(12-phenyldodec-9-ynylamino)benzoate

ethyl 4-(12-phenyldodec-9-ynylamino)benzoate

Systemtic Name:ethyl 4-(12-phenyldodec-9-ynylamino)benzoate
Openeye Name:ethyl 4-(12-phenyldodec-9-ynylamino)benzoate
CAS Name:4-(12-phenyldodec-9-ynylamino)benzoic acid ethyl ester
IUPAC Name:ethyl 4-(12-phenyldodec-9-ynylamino)benzoate
Traditional Name:4-(12-phenyldodec-9-ynylamino)benzoic acid ethyl ester
Formula: C27H35NO2
MolecularWeight: 405.5723
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCCCCCCCCC#CCCC2=CC=CC=C2


Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCCCCCCCCC#CCCC2=CC=CC=C2


InChI

InChI=1S/C27H35NO2/c1-2-30-27(29)25-19-21-26(22-20-25)28-23-15-10-8-6-4-3-5-7-9-12-16-24-17-13-11-14-18-24/h11,13-14,17-22,28H,2-6,8,10,12,15-16,23H2,1H3


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