3-[4-(3-methylphenyl)carbonylpiperazin-1-yl]propylazanium

Systemtic Name: 3-[4-(3-methylphenyl)carbonylpiperazin-1-yl]propylazanium Openeye Name: 3-[4-(3-methylbenzoyl)piperazin-1-yl]propylammonium CAS Name: 3-[4-[(3-methylphenyl)-oxomethyl]-1-piperazinyl]propylammonium IUPAC Name: 3-[4-(3-methylbenzoyl)piperazin-1-yl]propylazanium Traditional Name: 3-(4-m-toluoylpiperazino)propylammonium Formula: C15H24N3O+ MolecularWeight: 262.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)CCC[NH3+]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)CCC[NH3+]

InChI

InChI=1S/C15H23N3O/c1-13-4-2-5-14(12-13)15(19)18-10-8-17(9-11-18)7-3-6-16/h2,4-5,12H,3,6-11,16H2,1H3/p+1