6-[3-(4-phenylpiperazin-1-yl)propoxy]quinoline hydrate

Systemtic Name: 6-[3-(4-phenylpiperazin-1-yl)propoxy]quinoline hydrate Openeye Name: 6-[3-(4-phenylpiperazin-1-yl)propoxy]quinoline hydrate CAS Name: 6-[3-(4-phenyl-1-piperazinyl)propoxy]quinoline hydrate IUPAC Name: 6-[3-(4-phenylpiperazin-1-yl)propoxy]quinoline hydrate Traditional Name: 6-[3-(4-phenylpiperazino)propoxy]quinoline hydrate Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC3=C(C=C2)N=CC=C3)C4=CC=CC=C4.O

Isomeric SMILES

C1CN(CCN1CCCOC2=CC3=C(C=C2)N=CC=C3)C4=CC=CC=C4.O

InChI

InChI=1S/C22H25N3O.H2O/c1-2-7-20(8-3-1)25-15-13-24(14-16-25)12-5-17-26-21-9-10-22-19(18-21)6-4-11-23-22;/h1-4,6-11,18H,5,12-17H2;1H2