propan-2-yl 2-[[(E)-2-cyano-3-(4-cyclopropylcarbonyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[[(E)-2-cyano-3-(4-cyclopropylcarbonyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: isopropyl 2-[[(E)-2-cyano-3-[4-(cyclopropanecarbonyloxy)-3-methoxy-phenyl]prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-[4-[cyclopropyl(oxo)methoxy]-3-methoxyphenyl]-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[(E)-2-cyano-3-[4-(cyclopropanecarbonyloxy)-3-methoxyphenyl]prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-[4-(cyclopropanecarbonyloxy)-3-methoxy-phenyl]acryloyl]amino]thiophene-3-carboxylic acid isopropyl ester Formula: C23H22N2O6S MolecularWeight: 454.49558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3CC3)OC)C#N

Isomeric SMILES

CC(C)OC(=O)C1=C(SC=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OC(=O)C3CC3)OC)/C#N

InChI

InChI=1S/C23H22N2O6S/c1-13(2)30-23(28)17-8-9-32-21(17)25-20(26)16(12-24)10-14-4-7-18(19(11-14)29-3)31-22(27)15-5-6-15/h4,7-11,13,15H,5-6H2,1-3H3,(H,25,26)/b16-10+