5-azanyl-3-oxidanylidene-1-tridecyl-2H-pyrrole-4-carbonitrile

Systemtic Name: 5-azanyl-3-oxidanylidene-1-tridecyl-2H-pyrrole-4-carbonitrile Openeye Name: 5-amino-3-oxo-1-tridecyl-2H-pyrrole-4-carbonitrile CAS Name: 5-amino-3-oxo-1-tridecyl-2H-pyrrole-4-carbonitrile IUPAC Name: 5-amino-3-oxo-1-tridecyl-2H-pyrrole-4-carbonitrile Traditional Name: 2-amino-4-keto-1-tridecyl-2-pyrroline-3-carbonitrile Formula: C18H31N3O MolecularWeight: 305.45824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCN1CC(=O)C(=C1N)C#N

Isomeric SMILES

CCCCCCCCCCCCCN1CC(=O)C(=C1N)C#N

InChI

InChI=1S/C18H31N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-21-15-17(22)16(14-19)18(21)20/h2-13,15,20H2,1H3