[4-oxidanylidene-4-[4-(3-phenylpropanoyl)piperazin-1-yl]butyl]azanium

Systemtic Name: [4-oxidanylidene-4-[4-(3-phenylpropanoyl)piperazin-1-yl]butyl]azanium Openeye Name: [4-oxo-4-[4-(3-phenylpropanoyl)piperazin-1-yl]butyl]ammonium CAS Name: [4-oxo-4-[4-(1-oxo-3-phenylpropyl)-1-piperazinyl]butyl]ammonium IUPAC Name: [4-oxo-4-[4-(3-phenylpropanoyl)piperazin-1-yl]butyl]azanium Traditional Name: [4-(4-hydrocinnamoylpiperazino)-4-keto-butyl]ammonium Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC[NH3+])C(=O)CCC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1C(=O)CCC[NH3+])C(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C17H25N3O2/c18-10-4-7-16(21)19-11-13-20(14-12-19)17(22)9-8-15-5-2-1-3-6-15/h1-3,5-6H,4,7-14,18H2/p+1