5-[[3-(phenylmethyl)piperazin-1-yl]methyl]isoquinoline

Systemtic Name: 5-[[3-(phenylmethyl)piperazin-1-yl]methyl]isoquinoline Openeye Name: 5-[(3-benzylpiperazin-1-yl)methyl]isoquinoline CAS Name: 5-[[3-(phenylmethyl)-1-piperazinyl]methyl]isoquinoline IUPAC Name: 5-[(3-benzylpiperazin-1-yl)methyl]isoquinoline Traditional Name: 5-[(3-benzylpiperazino)methyl]isoquinoline Formula: C21H23N3 MolecularWeight: 317.42742

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)CC2=CC=CC=C2)CC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CC(N1)CC2=CC=CC=C2)CC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C21H23N3/c1-2-5-17(6-3-1)13-20-16-24(12-11-23-20)15-19-8-4-7-18-14-22-10-9-21(18)19/h1-10,14,20,23H,11-13,15-16H2