3-[(3-methoxy-4-phenylmethoxy-phenyl)-piperazin-1-yl-methyl]quinoline

Systemtic Name: 3-[(3-methoxy-4-phenylmethoxy-phenyl)-piperazin-1-yl-methyl]quinoline Openeye Name: 3-[(4-benzyloxy-3-methoxy-phenyl)-piperazin-1-yl-methyl]quinoline CAS Name: 3-[(3-methoxy-4-phenylmethoxyphenyl)-(1-piperazinyl)methyl]quinoline IUPAC Name: 3-[(3-methoxy-4-phenylmethoxyphenyl)-piperazin-1-ylmethyl]quinoline Traditional Name: 3-[(4-benzoxy-3-methoxy-phenyl)-piperazino-methyl]quinoline Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCNCC4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCNCC4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2/c1-32-27-18-23(11-12-26(27)33-20-21-7-3-2-4-8-21)28(31-15-13-29-14-16-31)24-17-22-9-5-6-10-25(22)30-19-24/h2-12,17-19,28-29H,13-16,20H2,1H3