3-(3-azanyl-4-ethanoyl-5-methyl-1H-pyrrol-2-yl)benzenecarbonitrile

Systemtic Name: 3-(3-azanyl-4-ethanoyl-5-methyl-1H-pyrrol-2-yl)benzenecarbonitrile Openeye Name: 3-(4-acetyl-3-amino-5-methyl-1H-pyrrol-2-yl)benzonitrile CAS Name: 3-(4-acetyl-3-amino-5-methyl-1H-pyrrol-2-yl)benzonitrile IUPAC Name: 3-(4-acetyl-3-amino-5-methyl-1H-pyrrol-2-yl)benzonitrile Traditional Name: 3-(4-acetyl-3-amino-5-methyl-1H-pyrrol-2-yl)benzonitrile Formula: C14H13N3O MolecularWeight: 239.27252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C2=CC=CC(=C2)C#N)N)C(=O)C

Isomeric SMILES

CC1=C(C(=C(N1)C2=CC=CC(=C2)C#N)N)C(=O)C

InChI

InChI=1S/C14H13N3O/c1-8-12(9(2)18)13(16)14(17-8)11-5-3-4-10(6-11)7-15/h3-6,17H,16H2,1-2H3