2-[4-[(3-carbamimidoylphenyl)carbonylamino]-3-[(4-propan-2-ylphenyl)carbonylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(3-carbamimidoylphenyl)carbonylamino]-3-[(4-propan-2-ylphenyl)carbonylamino]phenoxy]ethanoic acid Openeye Name: 2-[4-[(3-carbamimidoylbenzoyl)amino]-3-[(4-isopropylbenzoyl)amino]phenoxy]acetic acid CAS Name: 2-[4-[[(3-carbamimidoylphenyl)-oxomethyl]amino]-3-[[oxo-(4-propan-2-ylphenyl)methyl]amino]phenoxy]acetic acid IUPAC Name: 2-[4-[(3-carbamimidoylbenzoyl)amino]-3-[(4-propan-2-ylbenzoyl)amino]phenoxy]acetic acid Traditional Name: 2-[4-[(3-amidinobenzoyl)amino]-3-(cumoylamino)phenoxy]acetic acid Formula: C26H26N4O5 MolecularWeight: 474.50844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)OCC(=O)O)NC(=O)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)OCC(=O)O)NC(=O)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C26H26N4O5/c1-15(2)16-6-8-17(9-7-16)25(33)30-22-13-20(35-14-23(31)32)10-11-21(22)29-26(34)19-5-3-4-18(12-19)24(27)28/h3-13,15H,14H2,1-2H3,(H3,27,28)(H,29,34)(H,30,33)(H,31,32)