N-[(3-methoxyphenyl)methylideneamino]-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-[(3-methoxyphenyl)methylideneamino]-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(3-methoxyphenyl)methyleneamino]acetamide CAS Name: N-[(3-methoxyphenyl)methylideneamino]-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(3-methoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(m-anisylideneamino)acetamide Formula: C21H28N4O2+2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=NNC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C=NNC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O2/c1-27-20-9-5-8-19(14-20)15-22-23-21(26)17-25-12-10-24(11-13-25)16-18-6-3-2-4-7-18/h2-9,14-15H,10-13,16-17H2,1H3,(H,23,26)/p+2