ethyl 3-[6-(dimethylamino)-6-oxidanylidene-hex-1-ynyl]benzoate

Systemtic Name: ethyl 3-[6-(dimethylamino)-6-oxidanylidene-hex-1-ynyl]benzoate Openeye Name: ethyl 3-[6-(dimethylamino)-6-oxo-hex-1-ynyl]benzoate CAS Name: 3-[6-(dimethylamino)-6-oxohex-1-ynyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[6-(dimethylamino)-6-oxohex-1-ynyl]benzoate Traditional Name: 3-[6-(dimethylamino)-6-keto-hex-1-ynyl]benzoic acid ethyl ester Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C#CCCCC(=O)N(C)C

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C#CCCCC(=O)N(C)C

InChI

InChI=1S/C17H21NO3/c1-4-21-17(20)15-11-8-10-14(13-15)9-6-5-7-12-16(19)18(2)3/h8,10-11,13H,4-5,7,12H2,1-3H3