[[3-aminocarbonyl-5-(2-chloranylethanoylamino)phenyl]carbonyl-ethyl-amino]methyl ethanoate

Systemtic Name: [[3-aminocarbonyl-5-(2-chloranylethanoylamino)phenyl]carbonyl-ethyl-amino]methyl ethanoate Openeye Name: [[3-carbamoyl-5-[(2-chloroacetyl)amino]benzoyl]-ethyl-amino]methyl acetate CAS Name: acetic acid [[[3-carbamoyl-5-[(2-chloro-1-oxoethyl)amino]phenyl]-oxomethyl]-ethylamino]methyl ester IUPAC Name: [[3-carbamoyl-5-[(2-chloroacetyl)amino]benzoyl]-ethylamino]methyl acetate Traditional Name: acetic acid [[3-carbamoyl-5-[(2-chloroacetyl)amino]benzoyl]-ethyl-amino]methyl ester Formula: C15H18ClN3O5 MolecularWeight: 355.77352

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Descriptors Computed from Structure

Canonical SMILES:

CCN(COC(=O)C)C(=O)C1=CC(=CC(=C1)C(=O)N)NC(=O)CCl

Isomeric SMILES

CCN(COC(=O)C)C(=O)C1=CC(=CC(=C1)C(=O)N)NC(=O)CCl

InChI

InChI=1S/C15H18ClN3O5/c1-3-19(8-24-9(2)20)15(23)11-4-10(14(17)22)5-12(6-11)18-13(21)7-16/h4-6H,3,7-8H2,1-2H3,(H2,17,22)(H,18,21)