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

Systemtic Name: 12-[5-[(E)-[(5Z)-3-propoxy-5-pyrrol-2-ylidene-pyrrol-2-ylidene]methyl]-1H-pyrrol-2-yl]dodecanenitrile Openeye Name: 12-[5-[(E)-[(5Z)-3-propoxy-5-pyrrol-2-ylidene-pyrrol-2-ylidene]methyl]-1H-pyrrol-2-yl]dodecanenitrile CAS Name: 12-[5-[(E)-[(5Z)-3-propoxy-5-(2-pyrrolylidene)-2-pyrrolylidene]methyl]-1H-pyrrol-2-yl]dodecanenitrile IUPAC Name: 12-[5-[(E)-[(5Z)-3-propoxy-5-pyrrol-2-ylidenepyrrol-2-ylidene]methyl]-1H-pyrrol-2-yl]dodecanenitrile Traditional Name: 12-[5-[(E)-[(5Z)-3-propoxy-5-pyrrol-2-ylidene-3-pyrrolin-2-ylidene]methyl]-1H-pyrrol-2-yl]lauronitrile Formula: C28H38N4O MolecularWeight: 446.62752

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C2C=CC=N2)NC1=CC3=CC=C(N3)CCCCCCCCCCCC#N

Isomeric SMILES

CCCOC\1=C/C(=C/2\C=CC=N2)/N/C1=C/C3=CC=C(N3)CCCCCCCCCCCC#N

InChI

InChI=1S/C28H38N4O/c1-2-20-33-28-22-26(25-15-13-19-30-25)32-27(28)21-24-17-16-23(31-24)14-11-9-7-5-3-4-6-8-10-12-18-29/h13,15-17,19,21-22,31-32H,2-12,14,20H2,1H3/b26-25-,27-21+