6-[[4-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]isoquinoline

Systemtic Name: 6-[[4-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]isoquinoline Openeye Name: 6-[[4-[4-(3-benzyloxypropoxy)phenyl]-3-piperidyl]oxymethyl]isoquinoline CAS Name: 6-[[4-[4-(3-phenylmethoxypropoxy)phenyl]-3-piperidinyl]oxymethyl]isoquinoline IUPAC Name: 6-[[4-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]isoquinoline Traditional Name: 6-[[4-[4-(3-benzoxypropoxy)phenyl]-3-piperidyl]oxymethyl]isoquinoline Formula: C31H34N2O3 MolecularWeight: 482.61326

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=CC=C(C=C2)OCCCOCC3=CC=CC=C3)OCC4=CC5=C(C=C4)C=NC=C5

Isomeric SMILES

C1CNCC(C1C2=CC=C(C=C2)OCCCOCC3=CC=CC=C3)OCC4=CC5=C(C=C4)C=NC=C5

InChI

InChI=1S/C31H34N2O3/c1-2-5-24(6-3-1)22-34-17-4-18-35-29-11-9-26(10-12-29)30-14-16-33-21-31(30)36-23-25-7-8-28-20-32-15-13-27(28)19-25/h1-3,5-13,15,19-20,30-31,33H,4,14,16-18,21-23H2