propan-2-yl 2-[[(E)-3-(6-chloranyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[[(E)-3-(6-chloranyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: isopropyl 2-[[(E)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyano-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[(E)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyanoprop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyano-acryloyl]amino]thiophene-3-carboxylic acid isopropyl ester Formula: C19H15ClN2O5S MolecularWeight: 418.8508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC=C1)NC(=O)C(=CC2=CC3=C(C=C2Cl)OCO3)C#N

Isomeric SMILES

CC(C)OC(=O)C1=C(SC=C1)NC(=O)/C(=C/C2=CC3=C(C=C2Cl)OCO3)/C#N

InChI

InChI=1S/C19H15ClN2O5S/c1-10(2)27-19(24)13-3-4-28-18(13)22-17(23)12(8-21)5-11-6-15-16(7-14(11)20)26-9-25-15/h3-7,10H,9H2,1-2H3,(H,22,23)/b12-5+