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

Systemtic Name: 1-[2-[4-chloranyl-3-[5-(4-methoxyphenyl)pyridin-3-yl]indol-1-yl]ethyl]piperidine-4-carbonitrile Openeye Name: 1-[2-[4-chloro-3-[5-(4-methoxyphenyl)-3-pyridyl]indol-1-yl]ethyl]piperidine-4-carbonitrile CAS Name: 1-[2-[4-chloro-3-[5-(4-methoxyphenyl)-3-pyridinyl]-1-indolyl]ethyl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-[4-chloro-3-[5-(4-methoxyphenyl)pyridin-3-yl]indol-1-yl]ethyl]piperidine-4-carbonitrile Traditional Name: 1-[2-[4-chloro-3-[5-(4-methoxyphenyl)-3-pyridyl]indol-1-yl]ethyl]isonipecotonitrile Formula: C28H27ClN4O MolecularWeight: 470.99318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=CN=C2)C3=CN(C4=C3C(=CC=C4)Cl)CCN5CCC(CC5)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=CN=C2)C3=CN(C4=C3C(=CC=C4)Cl)CCN5CCC(CC5)C#N

InChI

InChI=1S/C28H27ClN4O/c1-34-24-7-5-21(6-8-24)22-15-23(18-31-17-22)25-19-33(27-4-2-3-26(29)28(25)27)14-13-32-11-9-20(16-30)10-12-32/h2-8,15,17-20H,9-14H2,1H3