N-(4-aminophenyl)carbonyl-2-(4-pyridin-2-ylpiperazin-1-yl)ethanamine oxide

Systemtic Name: N-(4-aminophenyl)carbonyl-2-(4-pyridin-2-ylpiperazin-1-yl)ethanamine oxide Openeye Name: N-(4-aminobenzoyl)-2-[4-(2-pyridyl)piperazin-1-yl]ethanamine oxide CAS Name: N-[(4-aminophenyl)-oxomethyl]-2-[4-(2-pyridinyl)-1-piperazinyl]ethanamine oxide IUPAC Name: N-(4-aminobenzoyl)-2-(4-pyridin-2-ylpiperazin-1-yl)ethanamine oxide Traditional Name: N-(4-aminobenzoyl)-2-[4-(2-pyridyl)piperazino]ethanamine oxide Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC[NH+](C(=O)C2=CC=C(C=C2)N)[O-])C3=CC=CC=N3

Isomeric SMILES

C1CN(CCN1CC[NH+](C(=O)C2=CC=C(C=C2)N)[O-])C3=CC=CC=N3

InChI

InChI=1S/C18H23N5O2/c19-16-6-4-15(5-7-16)18(24)23(25)14-11-21-9-12-22(13-10-21)17-3-1-2-8-20-17/h1-8,23H,9-14,19H2