1-[2-[6-chloranyl-3-(5-phenylpyridin-3-yl)indol-1-yl]ethyl]piperidine-4-carbonitrile

Systemtic Name: 1-[2-[6-chloranyl-3-(5-phenylpyridin-3-yl)indol-1-yl]ethyl]piperidine-4-carbonitrile Openeye Name: 1-[2-[6-chloro-3-(5-phenyl-3-pyridyl)indol-1-yl]ethyl]piperidine-4-carbonitrile CAS Name: 1-[2-[6-chloro-3-(5-phenyl-3-pyridinyl)-1-indolyl]ethyl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-[6-chloro-3-(5-phenylpyridin-3-yl)indol-1-yl]ethyl]piperidine-4-carbonitrile Traditional Name: 1-[2-[6-chloro-3-(5-phenyl-3-pyridyl)indol-1-yl]ethyl]isonipecotonitrile Formula: C27H25ClN4 MolecularWeight: 440.9672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C#N)CCN2C=C(C3=C2C=C(C=C3)Cl)C4=CN=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C#N)CCN2C=C(C3=C2C=C(C=C3)Cl)C4=CN=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25ClN4/c28-24-6-7-25-26(23-14-22(17-30-18-23)21-4-2-1-3-5-21)19-32(27(25)15-24)13-12-31-10-8-20(16-29)9-11-31/h1-7,14-15,17-20H,8-13H2