3-[(E)-2-[3-[methyl(2-methylpropanoyl)amino]phenyl]ethenyl]thiophene-2-carboxylate

Systemtic Name: 3-[(E)-2-[3-[methyl(2-methylpropanoyl)amino]phenyl]ethenyl]thiophene-2-carboxylate Openeye Name: 3-[(E)-2-[3-[methyl(2-methylpropanoyl)amino]phenyl]vinyl]thiophene-2-carboxylate CAS Name: 3-[(E)-2-[3-[methyl-(2-methyl-1-oxopropyl)amino]phenyl]ethenyl]-2-thiophenecarboxylate IUPAC Name: 3-[(E)-2-[3-[methyl(2-methylpropanoyl)amino]phenyl]ethenyl]thiophene-2-carboxylate Traditional Name: 3-[(E)-2-[3-[isobutyryl(methyl)amino]phenyl]vinyl]-2-thenoate Formula: C18H18NO3S- MolecularWeight: 328.40542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N(C)C1=CC=CC(=C1)C=CC2=C(SC=C2)C(=O)[O-]

Isomeric SMILES

CC(C)C(=O)N(C)C1=CC=CC(=C1)/C=C/C2=C(SC=C2)C(=O)[O-]

InChI

InChI=1S/C18H19NO3S/c1-12(2)17(20)19(3)15-6-4-5-13(11-15)7-8-14-9-10-23-16(14)18(21)22/h4-12H,1-3H3,(H,21,22)/p-1/b8-7+