ethyl 1-[2-(dibutylamino)-2-oxidanylidene-ethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-(dibutylamino)-2-oxidanylidene-ethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(dibutylamino)-2-oxo-ethyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylate CAS Name: 1-[2-(dibutylamino)-2-oxoethyl]-2-methyl-5-(4-methylphenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(dibutylamino)-2-oxoethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 1-[2-(dibutylamino)-2-keto-ethyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylic acid ethyl ester Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CN1C(=C(C=C1C2=CC=C(C=C2)C)C(=O)OCC)C

Isomeric SMILES

CCCCN(CCCC)C(=O)CN1C(=C(C=C1C2=CC=C(C=C2)C)C(=O)OCC)C

InChI

InChI=1S/C25H36N2O3/c1-6-9-15-26(16-10-7-2)24(28)18-27-20(5)22(25(29)30-8-3)17-23(27)21-13-11-19(4)12-14-21/h11-14,17H,6-10,15-16,18H2,1-5H3