12-[(5E)-5-[1-methyl-3-propoxy-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecan-1-ol

Systemtic Name: 12-[(5E)-5-[1-methyl-3-propoxy-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecan-1-ol Openeye Name: 12-[(5E)-5-[1-methyl-3-propoxy-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecan-1-ol CAS Name: 12-[(5E)-5-[1-methyl-3-propoxy-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]-2-pyrrolyl]-1-dodecanol IUPAC Name: 12-[(5E)-5-[1-methyl-3-propoxy-5-(1H-pyrrol-2-yl)-3H-pyrrol-2-ylidene]pyrrol-2-yl]dodecan-1-ol Traditional Name: 12-[(5E)-5-[1-methyl-3-propoxy-5-(1H-pyrrol-2-yl)-2-pyrrolin-2-ylidene]pyrrol-2-yl]dodecan-1-ol Formula: C28H43N3O2 MolecularWeight: 453.65992

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1C=C(N(C1=C2C=CC(=N2)CCCCCCCCCCCCO)C)C3=CC=CN3

Isomeric SMILES

CCCOC\1C=C(N(/C1=C/2\C=CC(=N2)CCCCCCCCCCCCO)C)C3=CC=CN3

InChI

InChI=1S/C28H43N3O2/c1-3-21-33-27-22-26(24-16-14-19-29-24)31(2)28(27)25-18-17-23(30-25)15-12-10-8-6-4-5-7-9-11-13-20-32/h14,16-19,22,27,29,32H,3-13,15,20-21H2,1-2H3/b28-25+