benzenecarbonitrile; 2-phenyl-1H-indole; pyrrolidin-2-one

Systemtic Name: benzenecarbonitrile; 2-phenyl-1H-indole; pyrrolidin-2-one Openeye Name: benzonitrile; 2-phenyl-1H-indole; pyrrolidin-2-one CAS Name: benzonitrile; 2-phenyl-1H-indole; 2-pyrrolidinone IUPAC Name: benzonitrile; 2-phenyl-1H-indole; pyrrolidin-2-one Traditional Name: benzonitrile; 2-phenyl-1H-indole; 2-pyrrolidone Formula: C25H23N3O MolecularWeight: 381.46962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC1.C1=CC=C(C=C1)C#N.C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2

Isomeric SMILES

C1CC(=O)NC1.C1=CC=C(C=C1)C#N.C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C14H11N.C7H5N.C4H7NO/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14;8-6-7-4-2-1-3-5-7;6-4-2-1-3-5-4/h1-10,15H;1-5H;1-3H2,(H,5,6)