[2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate Openeye Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 2-(4-chloro-3-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-3-methylphenoxy)acetic acid [2-oxo-2-(1-phenylbutylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 2-(4-chloro-3-methylphenoxy)acetate Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid [2-keto-2-(1-phenylbutylamino)ethyl] ester Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)COC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)COC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C21H24ClNO4/c1-3-7-19(16-8-5-4-6-9-16)23-20(24)13-27-21(25)14-26-17-10-11-18(22)15(2)12-17/h4-6,8-12,19H,3,7,13-14H2,1-2H3,(H,23,24)