ethyl 5-[3-(2-chloroethylcarbamoylamino)phenyl]pentanoate

Systemtic Name: ethyl 5-[3-(2-chloroethylcarbamoylamino)phenyl]pentanoate Openeye Name: ethyl 5-[3-(2-chloroethylcarbamoylamino)phenyl]pentanoate CAS Name: 5-[3-[[(2-chloroethylamino)-oxomethyl]amino]phenyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[3-(2-chloroethylcarbamoylamino)phenyl]pentanoate Traditional Name: 5-[3-(2-chloroethylcarbamoylamino)phenyl]valeric acid ethyl ester Formula: C16H23ClN2O3 MolecularWeight: 326.81842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC1=CC(=CC=C1)NC(=O)NCCCl

Isomeric SMILES

CCOC(=O)CCCCC1=CC(=CC=C1)NC(=O)NCCCl

InChI

InChI=1S/C16H23ClN2O3/c1-2-22-15(20)9-4-3-6-13-7-5-8-14(12-13)19-16(21)18-11-10-17/h5,7-8,12H,2-4,6,9-11H2,1H3,(H2,18,19,21)