4-phenyl-1-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 4-phenyl-1-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[3-(4-benzylpiperazin-1-yl)propyl]-4-phenyl-1,2,3,4-tetrahydroisoquinoline CAS Name: 4-phenyl-1-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[3-(4-benzylpiperazin-1-yl)propyl]-4-phenyl-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-[3-(4-benzylpiperazino)propyl]-4-phenyl-1,2,3,4-tetrahydroisoquinoline Formula: C29H35N3 MolecularWeight: 425.6083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2C3=CC=CC=C3C(CN2)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCC2C3=CC=CC=C3C(CN2)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H35N3/c1-3-10-24(11-4-1)23-32-20-18-31(19-21-32)17-9-16-29-27-15-8-7-14-26(27)28(22-30-29)25-12-5-2-6-13-25/h1-8,10-15,28-30H,9,16-23H2