ethyl 2-[[3-(4-chlorophenyl)-3-(4-isocyanophenoxy)propyl]-methyl-amino]ethanoate

Systemtic Name: ethyl 2-[[3-(4-chlorophenyl)-3-(4-isocyanophenoxy)propyl]-methyl-amino]ethanoate Openeye Name: ethyl 2-[[3-(4-chlorophenyl)-3-(4-isocyanophenoxy)propyl]-methyl-amino]acetate CAS Name: 2-[[3-(4-chlorophenyl)-3-(4-isocyanophenoxy)propyl]-methylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-(4-chlorophenyl)-3-(4-isocyanophenoxy)propyl]-methylamino]acetate Traditional Name: 2-[[3-(4-chlorophenyl)-3-(4-isocyanophenoxy)propyl]-methyl-amino]acetic acid ethyl ester Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C)CCC(C1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)[N+]#[C-]

Isomeric SMILES

CCOC(=O)CN(C)CCC(C1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)[N+]#[C-]

InChI

InChI=1S/C21H23ClN2O3/c1-4-26-21(25)15-24(3)14-13-20(16-5-7-17(22)8-6-16)27-19-11-9-18(23-2)10-12-19/h5-12,20H,4,13-15H2,1,3H3