[3-[4-[2-(4-methylphenoxy)ethanoyl]piperazin-1-yl]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[4-[2-(4-methylphenoxy)ethanoyl]piperazin-1-yl]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[4-[2-(4-methylphenoxy)acetyl]piperazin-1-yl]-3-oxo-propyl]ammonium CAS Name: [3-[4-[2-(4-methylphenoxy)-1-oxoethyl]-1-piperazinyl]-3-oxopropyl]ammonium IUPAC Name: [3-[4-[2-(4-methylphenoxy)acetyl]piperazin-1-yl]-3-oxopropyl]azanium Traditional Name: [3-keto-3-[4-[2-(4-methylphenoxy)acetyl]piperazino]propyl]ammonium Formula: C16H24N3O3+ MolecularWeight: 306.38006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O3/c1-13-2-4-14(5-3-13)22-12-16(21)19-10-8-18(9-11-19)15(20)6-7-17/h2-5H,6-12,17H2,1H3/p+1