2-(2-acetyloxy-5-carbamimidoyl-phenoxy)ethyl 4-(C-pyrrolidin-1-ylcarbonimidoyl)benzoate

Systemtic Name: 2-(2-acetyloxy-5-carbamimidoyl-phenoxy)ethyl 4-(C-pyrrolidin-1-ylcarbonimidoyl)benzoate Openeye Name: 2-(2-acetoxy-5-carbamimidoyl-phenoxy)ethyl 4-(pyrrolidine-1-carboximidoyl)benzoate CAS Name: 4-[imino(1-pyrrolidinyl)methyl]benzoic acid 2-(2-acetyloxy-5-carbamimidoylphenoxy)ethyl ester IUPAC Name: 2-(2-acetyloxy-5-carbamimidoylphenoxy)ethyl 4-(pyrrolidine-1-carboximidoyl)benzoate Traditional Name: 4-(pyrrolidine-1-carboximidoyl)benzoic acid 2-(2-acetoxy-5-amidino-phenoxy)ethyl ester Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(=N)N)OCCOC(=O)C2=CC=C(C=C2)C(=N)N3CCCC3

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(=N)N)OCCOC(=O)C2=CC=C(C=C2)C(=N)N3CCCC3

InChI

InChI=1S/C23H26N4O5/c1-15(28)32-19-9-8-18(21(24)25)14-20(19)30-12-13-31-23(29)17-6-4-16(5-7-17)22(26)27-10-2-3-11-27/h4-9,14,26H,2-3,10-13H2,1H3,(H3,24,25)