[(3R)-4-[3-(dimethylamino)phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)butyl]azanium

Systemtic Name: [(3R)-4-[3-(dimethylamino)phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)butyl]azanium Openeye Name: [(3R)-4-[3-(dimethylamino)phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)butyl]ammonium CAS Name: [(3R)-4-[3-(dimethylamino)phenoxy]-3-(4-methyl-1-piperazin-4-iumyl)butyl]ammonium IUPAC Name: [(3R)-4-[3-(dimethylamino)phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)butyl]azanium Traditional Name: [(3R)-4-[3-(dimethylamino)phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)butyl]ammonium Formula: C17H32N4O+2 MolecularWeight: 308.46218

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(CC[NH3+])COC2=CC=CC(=C2)N(C)C

Isomeric SMILES

C[NH+]1CCN(CC1)[C@H](CC[NH3+])COC2=CC=CC(=C2)N(C)C

InChI

InChI=1S/C17H30N4O/c1-19(2)15-5-4-6-17(13-15)22-14-16(7-8-18)21-11-9-20(3)10-12-21/h4-6,13,16H,7-12,14,18H2,1-3H3/p+2/t16-/m1/s1