(phenylmethyl) 4-[[carbamimidoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]benzoate

Systemtic Name: (phenylmethyl) 4-[[carbamimidoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]benzoate Openeye Name: benzyl 4-[[tert-butoxycarbonyl(carbamimidoyl)amino]methyl]benzoate CAS Name: 4-[[carbamimidoyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[carbamimidoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]benzoate Traditional Name: 4-[[amidino(tert-butoxycarbonyl)amino]methyl]benzoic acid benzyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2)C(=N)N

InChI

InChI=1S/C21H25N3O4/c1-21(2,3)28-20(26)24(19(22)23)13-15-9-11-17(12-10-15)18(25)27-14-16-7-5-4-6-8-16/h4-12H,13-14H2,1-3H3,(H3,22,23)