2-morpholin-4-ylethyl 7-[2-[4-(5,5-dimethylhexyl)phenyl]-2-ethanoyl-hydrazinyl]hept-6-ynoate

Systemtic Name: 2-morpholin-4-ylethyl 7-[2-[4-(5,5-dimethylhexyl)phenyl]-2-ethanoyl-hydrazinyl]hept-6-ynoate Openeye Name: 2-morpholinoethyl 7-[2-acetyl-2-[4-(5,5-dimethylhexyl)phenyl]hydrazino]hept-6-ynoate CAS Name: 7-[2-acetyl-2-[4-(5,5-dimethylhexyl)phenyl]hydrazinyl]-6-heptynoic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl 7-[2-acetyl-2-[4-(5,5-dimethylhexyl)phenyl]hydrazinyl]hept-6-ynoate Traditional Name: 7-[N'-acetyl-N'-[4-(5,5-dimethylhexyl)phenyl]hydrazino]hept-6-ynoic acid 2-morpholinoethyl ester Formula: C29H45N3O4 MolecularWeight: 499.6853

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=C(C=C1)CCCCC(C)(C)C)NC#CCCCCC(=O)OCCN2CCOCC2

Isomeric SMILES

CC(=O)N(C1=CC=C(C=C1)CCCCC(C)(C)C)NC#CCCCCC(=O)OCCN2CCOCC2

InChI

InChI=1S/C29H45N3O4/c1-25(33)32(27-15-13-26(14-16-27)11-8-9-17-29(2,3)4)30-18-10-6-5-7-12-28(34)36-24-21-31-19-22-35-23-20-31/h13-16,30H,5-9,11-12,17,19-24H2,1-4H3