tert-butyl 2-[(E)-2-(5-ethoxycarbonyl-1H-pyrrol-2-yl)ethenyl]pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-[(E)-2-(5-ethoxycarbonyl-1H-pyrrol-2-yl)ethenyl]pyrrole-1-carboxylate Openeye Name: tert-butyl 2-[(E)-2-(5-ethoxycarbonyl-1H-pyrrol-2-yl)vinyl]pyrrole-1-carboxylate CAS Name: 2-[(E)-2-(5-ethoxycarbonyl-1H-pyrrol-2-yl)ethenyl]-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(E)-2-(5-ethoxycarbonyl-1H-pyrrol-2-yl)ethenyl]pyrrole-1-carboxylate Traditional Name: 2-[(E)-2-(5-carbethoxy-1H-pyrrol-2-yl)vinyl]pyrrole-1-carboxylic acid tert-butyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(N1)C=CC2=CC=CN2C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(N1)/C=C/C2=CC=CN2C(=O)OC(C)(C)C

InChI

InChI=1S/C18H22N2O4/c1-5-23-16(21)15-11-9-13(19-15)8-10-14-7-6-12-20(14)17(22)24-18(2,3)4/h6-12,19H,5H2,1-4H3/b10-8+