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

Systemtic Name: 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecanamide Openeye Name: 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecanamide CAS Name: 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]-2-pyrrolyl]dodecanamide IUPAC Name: 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecanamide Traditional Name: 12-[(5E)-5-[3-ethoxy-1-methyl-5-(1H-pyrrol-2-yl)-2-pyrrolin-2-ylidene]pyrrol-2-yl]lauramide Formula: C27H40N4O2 MolecularWeight: 452.6321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H40N4O2/c1-3-33-25-20-24(22-15-13-19-29-22)31(2)27(25)23-18-17-21(30-23)14-11-9-7-5-4-6-8-10-12-16-26(28)32/h13,15,17-20,25,29H,3-12,14,16H2,1-2H3,(H2,28,32)/b27-23+