propan-2-yl 2-[4-[(4-carbamimidoylphenyl)carbonylcarbamoylamino]-3-methyl-phenoxy]ethanoate

Systemtic Name: propan-2-yl 2-[4-[(4-carbamimidoylphenyl)carbonylcarbamoylamino]-3-methyl-phenoxy]ethanoate Openeye Name: isopropyl 2-[4-[(4-carbamimidoylbenzoyl)carbamoylamino]-3-methyl-phenoxy]acetate CAS Name: 2-[4-[[[[(4-carbamimidoylphenyl)-oxomethyl]amino]-oxomethyl]amino]-3-methylphenoxy]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[4-[(4-carbamimidoylbenzoyl)carbamoylamino]-3-methylphenoxy]acetate Traditional Name: 2-[4-[(4-amidinobenzoyl)carbamoylamino]-3-methyl-phenoxy]acetic acid isopropyl ester Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OC(C)C)NC(=O)NC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OC(C)C)NC(=O)NC(=O)C2=CC=C(C=C2)C(=N)N

InChI

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