tert-butyl 2-[4-[(4-carbamimidoylphenyl)carbonylcarbamoylamino]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[4-[(4-carbamimidoylphenyl)carbonylcarbamoylamino]phenoxy]ethanoate Openeye Name: tert-butyl 2-[4-[(4-carbamimidoylbenzoyl)carbamoylamino]phenoxy]acetate CAS Name: 2-[4-[[[[(4-carbamimidoylphenyl)-oxomethyl]amino]-oxomethyl]amino]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(4-carbamimidoylbenzoyl)carbamoylamino]phenoxy]acetate Traditional Name: 2-[4-[(4-amidinobenzoyl)carbamoylamino]phenoxy]acetic acid tert-butyl ester Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=C(C=C1)NC(=O)NC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=C(C=C1)NC(=O)NC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C21H24N4O5/c1-21(2,3)30-17(26)12-29-16-10-8-15(9-11-16)24-20(28)25-19(27)14-6-4-13(5-7-14)18(22)23/h4-11H,12H2,1-3H3,(H3,22,23)(H2,24,25,27,28)