4-carbamimidoyl-N-[1-(3-carbamimidoylphenoxy)-3-(4-hydroxyphenyl)propan-2-yl]benzamide

Systemtic Name: 4-carbamimidoyl-N-[1-(3-carbamimidoylphenoxy)-3-(4-hydroxyphenyl)propan-2-yl]benzamide Openeye Name: 4-carbamimidoyl-N-[1-[(3-carbamimidoylphenoxy)methyl]-2-(4-hydroxyphenyl)ethyl]benzamide CAS Name: 4-carbamimidoyl-N-[1-(3-carbamimidoylphenoxy)-3-(4-hydroxyphenyl)propan-2-yl]benzamide IUPAC Name: 4-carbamimidoyl-N-[1-(3-carbamimidoylphenoxy)-3-(4-hydroxyphenyl)propan-2-yl]benzamide Traditional Name: 4-amidino-N-[1-[(3-amidinophenoxy)methyl]-2-(4-hydroxyphenyl)ethyl]benzamide Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(CC2=CC=C(C=C2)O)NC(=O)C3=CC=C(C=C3)C(=N)N)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)OCC(CC2=CC=C(C=C2)O)NC(=O)C3=CC=C(C=C3)C(=N)N)C(=N)N

InChI

InChI=1S/C24H25N5O3/c25-22(26)16-6-8-17(9-7-16)24(31)29-19(12-15-4-10-20(30)11-5-15)14-32-21-3-1-2-18(13-21)23(27)28/h1-11,13,19,30H,12,14H2,(H3,25,26)(H3,27,28)(H,29,31)