2-methoxyethyl 4-[[(3E,5E)-6-chloranylhexa-1,3,5-trien-3-yl]carbamoylamino]benzoate

Systemtic Name: 2-methoxyethyl 4-[[(3E,5E)-6-chloranylhexa-1,3,5-trien-3-yl]carbamoylamino]benzoate Openeye Name: 2-methoxyethyl 4-[[(1E,3E)-4-chloro-1-vinyl-buta-1,3-dienyl]carbamoylamino]benzoate CAS Name: 4-[[[[(3E,5E)-6-chlorohexa-1,3,5-trien-3-yl]amino]-oxomethyl]amino]benzoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[[(3E,5E)-6-chlorohexa-1,3,5-trien-3-yl]carbamoylamino]benzoate Traditional Name: 4-[[(1E,3E)-4-chloro-1-vinyl-buta-1,3-dienyl]carbamoylamino]benzoic acid 2-methoxyethyl ester Formula: C17H19ClN2O4 MolecularWeight: 350.79676

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=CC=C(C=C1)NC(=O)NC(=CC=CCl)C=C

Isomeric SMILES

COCCOC(=O)C1=CC=C(C=C1)NC(=O)N/C(=C/C=C/Cl)/C=C

InChI

InChI=1S/C17H19ClN2O4/c1-3-14(5-4-10-18)19-17(22)20-15-8-6-13(7-9-15)16(21)24-12-11-23-2/h3-10H,1,11-12H2,2H3,(H2,19,20,22)/b10-4+,14-5+