2-[[3-(2-acetyloxyethylcarbamoyl)-5-(2-chloranylethanoylamino)phenyl]carbonylamino]ethyl ethanoate

Systemtic Name: 2-[[3-(2-acetyloxyethylcarbamoyl)-5-(2-chloranylethanoylamino)phenyl]carbonylamino]ethyl ethanoate Openeye Name: 2-[[3-(2-acetoxyethylcarbamoyl)-5-[(2-chloroacetyl)amino]benzoyl]amino]ethyl acetate CAS Name: acetic acid 2-[[[3-[(2-acetyloxyethylamino)-oxomethyl]-5-[(2-chloro-1-oxoethyl)amino]phenyl]-oxomethyl]amino]ethyl ester IUPAC Name: 2-[[3-(2-acetyloxyethylcarbamoyl)-5-[(2-chloroacetyl)amino]benzoyl]amino]ethyl acetate Traditional Name: acetic acid 2-[[3-(2-acetoxyethylcarbamoyl)-5-[(2-chloroacetyl)amino]benzoyl]amino]ethyl ester Formula: C18H22ClN3O7 MolecularWeight: 427.83618

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCNC(=O)C1=CC(=CC(=C1)NC(=O)CCl)C(=O)NCCOC(=O)C

Isomeric SMILES

CC(=O)OCCNC(=O)C1=CC(=CC(=C1)NC(=O)CCl)C(=O)NCCOC(=O)C

InChI

InChI=1S/C18H22ClN3O7/c1-11(23)28-5-3-20-17(26)13-7-14(9-15(8-13)22-16(25)10-19)18(27)21-4-6-29-12(2)24/h7-9H,3-6,10H2,1-2H3,(H,20,26)(H,21,27)(H,22,25)