4-[3-[4-[3-(4-carbamimidoylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-2-oxidanyl-propoxy]benzenecarboximidamide

Systemtic Name: 4-[3-[4-[3-(4-carbamimidoylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-2-oxidanyl-propoxy]benzenecarboximidamide Openeye Name: 4-[3-[4-[3-(4-carbamimidoylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]-2-hydroxy-propoxy]benzamidine CAS Name: 4-[3-[4-[3-(4-carbamimidoylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-2-hydroxypropoxy]benzenecarboximidamide IUPAC Name: 4-[3-[4-[3-(4-carbamimidoylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-2-hydroxypropoxy]benzenecarboximidamide Traditional Name: 4-[3-[4-[3-(4-amidinophenoxy)-2-hydroxy-propyl]piperazino]-2-hydroxy-propoxy]benzamidine Formula: C24H34N6O4 MolecularWeight: 470.56456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)C(=N)N)O)CC(COC3=CC=C(C=C3)C(=N)N)O

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)C(=N)N)O)CC(COC3=CC=C(C=C3)C(=N)N)O

InChI

InChI=1S/C24H34N6O4/c25-23(26)17-1-5-21(6-2-17)33-15-19(31)13-29-9-11-30(12-10-29)14-20(32)16-34-22-7-3-18(4-8-22)24(27)28/h1-8,19-20,31-32H,9-16H2,(H3,25,26)(H3,27,28)