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

Systemtic Name: methyl 5-[3-(2-chloroethylcarbamoylamino)phenyl]pentanoate Openeye Name: methyl 5-[3-(2-chloroethylcarbamoylamino)phenyl]pentanoate CAS Name: 5-[3-[[(2-chloroethylamino)-oxomethyl]amino]phenyl]pentanoic acid methyl ester IUPAC Name: methyl 5-[3-(2-chloroethylcarbamoylamino)phenyl]pentanoate Traditional Name: 5-[3-(2-chloroethylcarbamoylamino)phenyl]valeric acid methyl ester Formula: C15H21ClN2O3 MolecularWeight: 312.79184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21ClN2O3/c1-21-14(19)8-3-2-5-12-6-4-7-13(11-12)18-15(20)17-10-9-16/h4,6-7,11H,2-3,5,8-10H2,1H3,(H2,17,18,20)