ethyl 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecanoate

Systemtic Name: ethyl 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecanoate Openeye Name: ethyl 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecanoate CAS Name: 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]-2-pyrrolyl]dodecanoic acid ethyl ester IUPAC Name: ethyl 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecanoate Traditional Name: 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-2-pyrrolin-2-ylidene]pyrrol-2-yl]lauric acid ethyl ester Formula: C29H43N3O3 MolecularWeight: 481.67002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C=C(N(C1=C2C=CC(=N2)CCCCCCCCCCCC(=O)OCC)C)C3=CC=CN3

Isomeric SMILES

CCOC\1C=C(N(/C1=C/2\C=CC(=N2)CCCCCCCCCCCC(=O)OCC)C)C3=CC=CN3

InChI

InChI=1S/C29H43N3O3/c1-4-34-27-22-26(24-17-15-21-30-24)32(3)29(27)25-20-19-23(31-25)16-13-11-9-7-6-8-10-12-14-18-28(33)35-5-2/h15,17,19-22,27,30H,4-14,16,18H2,1-3H3/b29-25+