3-[(3-phenoxyphenyl)-piperazin-1-yl-methyl]quinoline

Systemtic Name: 3-[(3-phenoxyphenyl)-piperazin-1-yl-methyl]quinoline Openeye Name: 3-[(3-phenoxyphenyl)-piperazin-1-yl-methyl]quinoline CAS Name: 3-[(3-phenoxyphenyl)-(1-piperazinyl)methyl]quinoline IUPAC Name: 3-[(3-phenoxyphenyl)-piperazin-1-ylmethyl]quinoline Traditional Name: 3-[(3-phenoxyphenyl)-piperazino-methyl]quinoline Formula: C26H25N3O MolecularWeight: 395.4962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC5=CC=CC=C5N=C4

Isomeric SMILES

C1CN(CCN1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C26H25N3O/c1-2-9-23(10-3-1)30-24-11-6-8-21(18-24)26(29-15-13-27-14-16-29)22-17-20-7-4-5-12-25(20)28-19-22/h1-12,17-19,26-27H,13-16H2