[4-[2-(4-cyclobutylcarbonylpiperazin-1-yl)ethoxy]phenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium

Systemtic Name: [4-[2-(4-cyclobutylcarbonylpiperazin-1-yl)ethoxy]phenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium Openeye Name: [4-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethoxy]phenyl]methyl-methyl-(6-quinolylmethyl)ammonium CAS Name: [4-[2-[4-[cyclobutyl(oxo)methyl]-1-piperazinyl]ethoxy]phenyl]methyl-methyl-(6-quinolinylmethyl)ammonium IUPAC Name: [4-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethoxy]phenyl]methyl-methyl-(quinolin-6-ylmethyl)azanium Traditional Name: [4-[2-[4-(cyclobutanecarbonyl)piperazino]ethoxy]benzyl]-methyl-(6-quinolylmethyl)ammonium Formula: C29H37N4O2+ MolecularWeight: 473.62968

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OCCN2CCN(CC2)C(=O)C3CCC3)CC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OCCN2CCN(CC2)C(=O)C3CCC3)CC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C29H36N4O2/c1-31(22-24-9-12-28-26(20-24)6-3-13-30-28)21-23-7-10-27(11-8-23)35-19-18-32-14-16-33(17-15-32)29(34)25-4-2-5-25/h3,6-13,20,25H,2,4-5,14-19,21-22H2,1H3/p+1