21-(5-methanoyl-1H-pyrrol-2-yl)henicosanenitrile

Systemtic Name: 21-(5-methanoyl-1H-pyrrol-2-yl)henicosanenitrile Openeye Name: 21-(5-formyl-1H-pyrrol-2-yl)henicosanenitrile CAS Name: 21-(5-formyl-1H-pyrrol-2-yl)heneicosanenitrile IUPAC Name: 21-(5-formyl-1H-pyrrol-2-yl)henicosanenitrile Traditional Name: 21-(5-formyl-1H-pyrrol-2-yl)heneicosanenitrile Formula: C26H44N2O MolecularWeight: 400.64036

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=C1)C=O)CCCCCCCCCCCCCCCCCCCCC#N

Isomeric SMILES

C1=C(NC(=C1)C=O)CCCCCCCCCCCCCCCCCCCCC#N

InChI

InChI=1S/C26H44N2O/c27-23-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-25-21-22-26(24-29)28-25/h21-22,24,28H,1-20H2