[4-[2-oxidanylidene-2-(4-propylpiperazin-1-yl)ethoxy]phenyl]methylazanium

Systemtic Name: [4-[2-oxidanylidene-2-(4-propylpiperazin-1-yl)ethoxy]phenyl]methylazanium Openeye Name: [4-[2-oxo-2-(4-propylpiperazin-1-yl)ethoxy]phenyl]methylammonium CAS Name: [4-[2-oxo-2-(4-propyl-1-piperazinyl)ethoxy]phenyl]methylammonium IUPAC Name: [4-[2-oxo-2-(4-propylpiperazin-1-yl)ethoxy]phenyl]methylazanium Traditional Name: [4-[2-keto-2-(4-propylpiperazino)ethoxy]benzyl]ammonium Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)COC2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

CCCN1CCN(CC1)C(=O)COC2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C16H25N3O2/c1-2-7-18-8-10-19(11-9-18)16(20)13-21-15-5-3-14(12-17)4-6-15/h3-6H,2,7-13,17H2,1H3/p+1