ethyl 2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]ethanoyl]phenoxy]-2-methoxy-ethanoate

Systemtic Name: ethyl 2-[4-[2-[(4-carbamimidoylphenyl)carbonylamino]ethanoyl]phenoxy]-2-methoxy-ethanoate Openeye Name: ethyl 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]acetyl]phenoxy]-2-methoxy-acetate CAS Name: 2-[4-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-oxoethyl]phenoxy]-2-methoxyacetic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-[(4-carbamimidoylbenzoyl)amino]acetyl]phenoxy]-2-methoxyacetate Traditional Name: 2-[4-[2-[(4-amidinobenzoyl)amino]acetyl]phenoxy]-2-methoxy-acetic acid ethyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(OC)OC1=CC=C(C=C1)C(=O)CNC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)C(OC)OC1=CC=C(C=C1)C(=O)CNC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C21H23N3O6/c1-3-29-20(27)21(28-2)30-16-10-8-13(9-11-16)17(25)12-24-19(26)15-6-4-14(5-7-15)18(22)23/h4-11,21H,3,12H2,1-2H3,(H3,22,23)(H,24,26)