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

Systemtic Name: 1-[2-[5-methoxy-3-[5-(3-methoxyphenyl)pyridin-3-yl]indol-1-yl]ethyl]piperidine-4-carbonitrile Openeye Name: 1-[2-[5-methoxy-3-[5-(3-methoxyphenyl)-3-pyridyl]indol-1-yl]ethyl]piperidine-4-carbonitrile CAS Name: 1-[2-[5-methoxy-3-[5-(3-methoxyphenyl)-3-pyridinyl]-1-indolyl]ethyl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-[5-methoxy-3-[5-(3-methoxyphenyl)pyridin-3-yl]indol-1-yl]ethyl]piperidine-4-carbonitrile Traditional Name: 1-[2-[5-methoxy-3-[5-(3-methoxyphenyl)-3-pyridyl]indol-1-yl]ethyl]isonipecotonitrile Formula: C29H30N4O2 MolecularWeight: 466.5741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2C3=CN=CC(=C3)C4=CC(=CC=C4)OC)CCN5CCC(CC5)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2C3=CN=CC(=C3)C4=CC(=CC=C4)OC)CCN5CCC(CC5)C#N

InChI

InChI=1S/C29H30N4O2/c1-34-25-5-3-4-22(15-25)23-14-24(19-31-18-23)28-20-33(29-7-6-26(35-2)16-27(28)29)13-12-32-10-8-21(17-30)9-11-32/h3-7,14-16,18-21H,8-13H2,1-2H3