methyl 5-chloranyl-4-(2,2-dimethylpropanoylamino)-2-prop-2-ynoxy-benzoate

Systemtic Name: methyl 5-chloranyl-4-(2,2-dimethylpropanoylamino)-2-prop-2-ynoxy-benzoate Openeye Name: methyl 5-chloro-4-(2,2-dimethylpropanoylamino)-2-prop-2-ynoxy-benzoate CAS Name: 5-chloro-4-[(2,2-dimethyl-1-oxopropyl)amino]-2-prop-2-ynoxybenzoic acid methyl ester IUPAC Name: methyl 5-chloro-4-(2,2-dimethylpropanoylamino)-2-prop-2-ynoxybenzoate Traditional Name: 5-chloro-4-(pivaloylamino)-2-propargyloxy-benzoic acid methyl ester Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=C(C(=C1)OCC#C)C(=O)OC)Cl

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=C(C(=C1)OCC#C)C(=O)OC)Cl

InChI

InChI=1S/C16H18ClNO4/c1-6-7-22-13-9-12(18-15(20)16(2,3)4)11(17)8-10(13)14(19)21-5/h1,8-9H,7H2,2-5H3,(H,18,20)