1-[2-[1,3-bis(oxidanylidene)-7aH-isoindol-3a-yl]ethyl]-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-[2-[1,3-bis(oxidanylidene)-7aH-isoindol-3a-yl]ethyl]-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-[2-(1,3-dioxo-7aH-isoindol-3a-yl)ethyl]-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-[2-(1,3-dioxo-7aH-isoindol-3a-yl)ethyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-[2-(1,3-dioxo-7aH-isoindol-3a-yl)ethyl]-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-[2-(1,3-diketo-7aH-isoindol-3a-yl)ethyl]-4-phenyl-isonipecotonitrile Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=CC=C2)CCC34C=CC=CC3C(=O)NC4=O

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=CC=C2)CCC34C=CC=CC3C(=O)NC4=O

InChI

InChI=1S/C22H23N3O2/c23-16-21(17-6-2-1-3-7-17)10-13-25(14-11-21)15-12-22-9-5-4-8-18(22)19(26)24-20(22)27/h1-9,18H,10-15H2,(H,24,26,27)