ethyl 2-[4-[(3-carbamimidoylphenyl)carbonylamino]-3-[(4-propan-2-ylphenyl)carbonylamino]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[(3-carbamimidoylphenyl)carbonylamino]-3-[(4-propan-2-ylphenyl)carbonylamino]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[(3-carbamimidoylbenzoyl)amino]-3-[(4-isopropylbenzoyl)amino]phenoxy]acetate CAS Name: 2-[4-[[(3-carbamimidoylphenyl)-oxomethyl]amino]-3-[[oxo-(4-propan-2-ylphenyl)methyl]amino]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(3-carbamimidoylbenzoyl)amino]-3-[(4-propan-2-ylbenzoyl)amino]phenoxy]acetate Traditional Name: 2-[4-[(3-amidinobenzoyl)amino]-3-(cumoylamino)phenoxy]acetic acid ethyl ester Formula: C28H30N4O5 MolecularWeight: 502.5616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC(=C(C=C1)NC(=O)C2=CC=CC(=C2)C(=N)N)NC(=O)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCOC(=O)COC1=CC(=C(C=C1)NC(=O)C2=CC=CC(=C2)C(=N)N)NC(=O)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C28H30N4O5/c1-4-36-25(33)16-37-22-12-13-23(31-28(35)21-7-5-6-20(14-21)26(29)30)24(15-22)32-27(34)19-10-8-18(9-11-19)17(2)3/h5-15,17H,4,16H2,1-3H3,(H3,29,30)(H,31,35)(H,32,34)