6-[[1-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]isoquinoline

Systemtic Name: 6-[[1-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]isoquinoline Openeye Name: 6-[[1-[4-(3-benzyloxypropoxy)phenyl]-3-piperidyl]oxymethyl]isoquinoline CAS Name: 6-[[1-[4-(3-phenylmethoxypropoxy)phenyl]-3-piperidinyl]oxymethyl]isoquinoline IUPAC Name: 6-[[1-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]isoquinoline Traditional Name: 6-[[1-[4-(3-benzoxypropoxy)phenyl]-3-piperidyl]oxymethyl]isoquinoline Formula: C31H34N2O3 MolecularWeight: 482.61326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=C(C=C2)OCCCOCC3=CC=CC=C3)OCC4=CC5=C(C=C4)C=NC=C5

Isomeric SMILES

C1CC(CN(C1)C2=CC=C(C=C2)OCCCOCC3=CC=CC=C3)OCC4=CC5=C(C=C4)C=NC=C5

InChI

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