[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]-(2-phenoxyphenyl)azanium

Systemtic Name: [2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]-(2-phenoxyphenyl)azanium Openeye Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]-(2-phenoxyphenyl)ammonium CAS Name: [2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]-(2-phenoxyphenyl)ammonium IUPAC Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]-(2-phenoxyphenyl)azanium Traditional Name: [2-keto-2-[4-(2-thenoyl)piperazino]ethyl]-(2-phenoxyphenyl)ammonium Formula: C23H24N3O3S+ MolecularWeight: 422.51996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C[NH2+]C2=CC=CC=C2OC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)C[NH2+]C2=CC=CC=C2OC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H23N3O3S/c27-22(25-12-14-26(15-13-25)23(28)21-11-6-16-30-21)17-24-19-9-4-5-10-20(19)29-18-7-2-1-3-8-18/h1-11,16,24H,12-15,17H2/p+1