methyl 4-chloranyl-2-[2-(2-ethynylphenyl)ethanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-2-[2-(2-ethynylphenyl)ethanoylamino]benzoate Openeye Name: methyl 4-chloro-2-[[2-(2-ethynylphenyl)acetyl]amino]benzoate CAS Name: 4-chloro-2-[[2-(2-ethynylphenyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[[2-(2-ethynylphenyl)acetyl]amino]benzoate Traditional Name: 4-chloro-2-[[2-(2-ethynylphenyl)acetyl]amino]benzoic acid methyl ester Formula: C18H14ClNO3 MolecularWeight: 327.76166

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CC2=CC=CC=C2C#C

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CC2=CC=CC=C2C#C

InChI

InChI=1S/C18H14ClNO3/c1-3-12-6-4-5-7-13(12)10-17(21)20-16-11-14(19)8-9-15(16)18(22)23-2/h1,4-9,11H,10H2,2H3,(H,20,21)