3-[4-[4-(3,4-dihydro-2H-chromen-6-yl)piperazin-1-yl]butyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[4-[4-(3,4-dihydro-2H-chromen-6-yl)piperazin-1-yl]butyl]-1H-indole-5-carbonitrile Openeye Name: 3-[4-(4-chroman-6-ylpiperazin-1-yl)butyl]-1H-indole-5-carbonitrile CAS Name: 3-[4-[4-(3,4-dihydro-2H-1-benzopyran-6-yl)-1-piperazinyl]butyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[4-[4-(3,4-dihydro-2H-chromen-6-yl)piperazin-1-yl]butyl]-1H-indole-5-carbonitrile Traditional Name: 3-[4-(4-chroman-6-ylpiperazino)butyl]-1H-indole-5-carbonitrile Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)N3CCN(CC3)CCCCC4=CNC5=C4C=C(C=C5)C#N)OC1

Isomeric SMILES

C1CC2=C(C=CC(=C2)N3CCN(CC3)CCCCC4=CNC5=C4C=C(C=C5)C#N)OC1

InChI

InChI=1S/C26H30N4O/c27-18-20-6-8-25-24(16-20)22(19-28-25)4-1-2-10-29-11-13-30(14-12-29)23-7-9-26-21(17-23)5-3-15-31-26/h6-9,16-17,19,28H,1-5,10-15H2