methyl 2-[[(Z)-N'-[(3-iodanylphenyl)carbamoyl]carbamimidoyl]-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[(Z)-N'-[(3-iodanylphenyl)carbamoyl]carbamimidoyl]-methyl-amino]ethanoate Openeye Name: methyl 2-[[(Z)-N'-[(3-iodophenyl)carbamoyl]carbamimidoyl]-methyl-amino]acetate CAS Name: 2-[[(Z)-amino-[(3-iodoanilino)-oxomethyl]iminomethyl]-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[(Z)-N'-[(3-iodophenyl)carbamoyl]carbamimidoyl]-methylamino]acetate Traditional Name: 2-[[(Z)-N'-[(3-iodophenyl)carbamoyl]amidino]-methyl-amino]acetic acid methyl ester Formula: C12H15IN4O3 MolecularWeight: 390.17697

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C(=NC(=O)NC1=CC(=CC=C1)I)N

Isomeric SMILES

CN(CC(=O)OC)/C(=N\C(=O)NC1=CC(=CC=C1)I)/N

InChI

InChI=1S/C12H15IN4O3/c1-17(7-10(18)20-2)11(14)16-12(19)15-9-5-3-4-8(13)6-9/h3-6H,7H2,1-2H3,(H3,14,15,16,19)