ethyl 2-butyl-4-(diethylaminomethyl)-3-hex-1-ynyl-6-methyl-benzoate

Systemtic Name: ethyl 2-butyl-4-(diethylaminomethyl)-3-hex-1-ynyl-6-methyl-benzoate Openeye Name: ethyl 2-butyl-4-(diethylaminomethyl)-3-hex-1-ynyl-6-methyl-benzoate CAS Name: 2-butyl-4-(diethylaminomethyl)-3-hex-1-ynyl-6-methylbenzoic acid ethyl ester IUPAC Name: ethyl 2-butyl-4-(diethylaminomethyl)-3-hex-1-ynyl-6-methylbenzoate Traditional Name: 2-butyl-4-(diethylaminomethyl)-3-hex-1-ynyl-6-methyl-benzoic acid ethyl ester Formula: C25H39NO2 MolecularWeight: 385.58266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C(=C(C=C1CN(CC)CC)C)C(=O)OCC)CCCC

Isomeric SMILES

CCCCC#CC1=C(C(=C(C=C1CN(CC)CC)C)C(=O)OCC)CCCC

InChI

InChI=1S/C25H39NO2/c1-7-12-14-15-17-22-21(19-26(9-3)10-4)18-20(6)24(25(27)28-11-5)23(22)16-13-8-2/h18H,7-14,16,19H2,1-6H3