[4-[4-(3-methylphenyl)carbonylpiperazin-1-yl]phenyl]methylazanium

Systemtic Name: [4-[4-(3-methylphenyl)carbonylpiperazin-1-yl]phenyl]methylazanium Openeye Name: [4-[4-(3-methylbenzoyl)piperazin-1-yl]phenyl]methylammonium CAS Name: [4-[4-[(3-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]methylammonium IUPAC Name: [4-[4-(3-methylbenzoyl)piperazin-1-yl]phenyl]methylazanium Traditional Name: [4-(4-m-toluoylpiperazino)benzyl]ammonium Formula: C19H24N3O+ MolecularWeight: 310.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C19H23N3O/c1-15-3-2-4-17(13-15)19(23)22-11-9-21(10-12-22)18-7-5-16(14-20)6-8-18/h2-8,13H,9-12,14,20H2,1H3/p+1