5-[4-azanyl-3-(2-oxidanylideneethyl)phenyl]-1-methyl-pyrrole-2-carbonitrile

Systemtic Name: 5-[4-azanyl-3-(2-oxidanylideneethyl)phenyl]-1-methyl-pyrrole-2-carbonitrile Openeye Name: 5-[4-amino-3-(2-oxoethyl)phenyl]-1-methyl-pyrrole-2-carbonitrile CAS Name: 5-[4-amino-3-(2-oxoethyl)phenyl]-1-methyl-2-pyrrolecarbonitrile IUPAC Name: 5-[4-amino-3-(2-oxoethyl)phenyl]-1-methylpyrrole-2-carbonitrile Traditional Name: 5-[4-amino-3-(2-ketoethyl)phenyl]-1-methyl-pyrrole-2-carbonitrile Formula: C14H13N3O MolecularWeight: 239.27252

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2=CC(=C(C=C2)N)CC=O)C#N

Isomeric SMILES

CN1C(=CC=C1C2=CC(=C(C=C2)N)CC=O)C#N

InChI

InChI=1S/C14H13N3O/c1-17-12(9-15)3-5-14(17)11-2-4-13(16)10(8-11)6-7-18/h2-5,7-8H,6,16H2,1H3