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ethyl 4-[3-[6-[(phenylmethyl)amino]hexoxy]but-1-ynyl]benzoate

ethyl 4-[3-[6-[(phenylmethyl)amino]hexoxy]but-1-ynyl]benzoate

Systemtic Name:ethyl 4-[3-[6-[(phenylmethyl)amino]hexoxy]but-1-ynyl]benzoate
Openeye Name:ethyl 4-[3-[6-(benzylamino)hexoxy]but-1-ynyl]benzoate
CAS Name:4-[3-[6-[(phenylmethyl)amino]hexoxy]but-1-ynyl]benzoic acid ethyl ester
IUPAC Name:ethyl 4-[3-[6-(benzylamino)hexoxy]but-1-ynyl]benzoate
Traditional Name:4-[3-[6-(benzylamino)hexoxy]but-1-ynyl]benzoic acid ethyl ester
Formula: C26H33NO3
MolecularWeight: 407.54512
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC(C)OCCCCCCNCC2=CC=CC=C2


Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC(C)OCCCCCCNCC2=CC=CC=C2


InChI

InChI=1S/C26H33NO3/c1-3-29-26(28)25-17-15-23(16-18-25)14-13-22(2)30-20-10-5-4-9-19-27-21-24-11-7-6-8-12-24/h6-8,11-12,15-18,22,27H,3-5,9-10,19-21H2,1-2H3


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