ethyl 4-[3-[di(propan-2-yl)amino]prop-1-ynyl]benzoate

Systemtic Name: ethyl 4-[3-[di(propan-2-yl)amino]prop-1-ynyl]benzoate Openeye Name: ethyl 4-[3-(diisopropylamino)prop-1-ynyl]benzoate CAS Name: 4-[3-[di(propan-2-yl)amino]prop-1-ynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[di(propan-2-yl)amino]prop-1-ynyl]benzoate Traditional Name: 4-[3-(diisopropylamino)prop-1-ynyl]benzoic acid ethyl ester Formula: C18H25NO2 MolecularWeight: 287.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CCN(C(C)C)C(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CCN(C(C)C)C(C)C

InChI

InChI=1S/C18H25NO2/c1-6-21-18(20)17-11-9-16(10-12-17)8-7-13-19(14(2)3)15(4)5/h9-12,14-15H,6,13H2,1-5H3