3-acetamido-N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxidanylidene-ethoxy]phenyl]methyl]-5-chloranyl-benzamide

Systemtic Name: 3-acetamido-N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxidanylidene-ethoxy]phenyl]methyl]-5-chloranyl-benzamide Openeye Name: 3-acetamido-N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxo-ethoxy]phenyl]methyl]-5-chloro-benzamide CAS Name: 3-acetamido-N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-5-chlorobenzamide IUPAC Name: 3-acetamido-N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-5-chlorobenzamide Traditional Name: 3-acetamido-N-[4-amidino-2-[2-keto-2-(methylamino)ethoxy]benzyl]-5-chloro-benzamide Formula: C20H22ClN5O4 MolecularWeight: 431.87278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC(=O)NC)Cl

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC(=O)NC)Cl

InChI

InChI=1S/C20H22ClN5O4/c1-11(27)26-16-6-14(5-15(21)8-16)20(29)25-9-13-4-3-12(19(22)23)7-17(13)30-10-18(28)24-2/h3-8H,9-10H2,1-2H3,(H3,22,23)(H,24,28)(H,25,29)(H,26,27)