2-[2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]carbonylphenyl]benzenecarbonitrile

Systemtic Name: 2-[2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]carbonylphenyl]benzenecarbonitrile Openeye Name: 2-[2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1-carbonyl]phenyl]benzonitrile CAS Name: 2-[2-[[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazinyl]-oxomethyl]phenyl]benzonitrile IUPAC Name: 2-[2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1-carbonyl]phenyl]benzonitrile Traditional Name: 2-[2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1-carbonyl]phenyl]benzonitrile Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCN2CCN(CC2)C(=O)C3=CC=CC=C3C4=CC=CC=C4C#N

Isomeric SMILES

COC1=CC=C(C=C1)OCCN2CCN(CC2)C(=O)C3=CC=CC=C3C4=CC=CC=C4C#N

InChI

InChI=1S/C27H27N3O3/c1-32-22-10-12-23(13-11-22)33-19-18-29-14-16-30(17-15-29)27(31)26-9-5-4-8-25(26)24-7-3-2-6-21(24)20-28/h2-13H,14-19H2,1H3