2-[2-oxidanylidene-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]ethoxy]benzamide

Systemtic Name: 2-[2-oxidanylidene-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]ethoxy]benzamide Openeye Name: 2-[2-[4-[(4-isopropylphenyl)methyl]piperazin-4-ium-1-yl]-2-oxo-ethoxy]benzamide CAS Name: 2-[2-oxo-2-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-4-iumyl]ethoxy]benzamide IUPAC Name: 2-[2-oxo-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]ethoxy]benzamide Traditional Name: 2-[2-[4-(4-isopropylbenzyl)piperazin-4-ium-1-yl]-2-keto-ethoxy]benzamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)COC3=CC=CC=C3C(=O)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)COC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C23H29N3O3/c1-17(2)19-9-7-18(8-10-19)15-25-11-13-26(14-12-25)22(27)16-29-21-6-4-3-5-20(21)23(24)28/h3-10,17H,11-16H2,1-2H3,(H2,24,28)/p+1