ethyl 2-chloranyl-5-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]carbamoylamino]benzoate

Systemtic Name: ethyl 2-chloranyl-5-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]carbamoylamino]benzoate Openeye Name: ethyl 2-chloro-5-[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]carbamoylamino]benzoate CAS Name: 2-chloro-5-[[[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]carbamoylamino]benzoate Traditional Name: 2-chloro-5-[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]carbamoylamino]benzoic acid ethyl ester Formula: C16H19ClN2O5 MolecularWeight: 354.78546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(=O)NC1=CC(=C(C=C1)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(=O)NC1=CC(=C(C=C1)Cl)C(=O)OCC

InChI

InChI=1S/C16H19ClN2O5/c1-4-23-14(20)8-10(3)18-16(22)19-11-6-7-13(17)12(9-11)15(21)24-5-2/h6-9H,4-5H2,1-3H3,(H2,18,19,22)/b10-8+