methyl 2-(3-ethylpent-1-yn-3-ylcarbamoylamino)benzoate

Systemtic Name: methyl 2-(3-ethylpent-1-yn-3-ylcarbamoylamino)benzoate Openeye Name: methyl 2-(1,1-diethylprop-2-ynylcarbamoylamino)benzoate CAS Name: 2-[[(3-ethylpent-1-yn-3-ylamino)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-(3-ethylpent-1-yn-3-ylcarbamoylamino)benzoate Traditional Name: 2-(1,1-diethylprop-2-ynylcarbamoylamino)benzoic acid methyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)NC1=CC=CC=C1C(=O)OC

Isomeric SMILES

CCC(CC)(C#C)NC(=O)NC1=CC=CC=C1C(=O)OC

InChI

InChI=1S/C16H20N2O3/c1-5-16(6-2,7-3)18-15(20)17-13-11-9-8-10-12(13)14(19)21-4/h1,8-11H,6-7H2,2-4H3,(H2,17,18,20)