methyl 2-[2-chloranyl-4-[[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)amino]methyl]-6-methoxy-phenoxy]ethanoate

Systemtic Name: methyl 2-[2-chloranyl-4-[[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)amino]methyl]-6-methoxy-phenoxy]ethanoate Openeye Name: methyl 2-[2-chloro-4-[(3-chloro-4-pyrrolidin-1-yl-anilino)methyl]-6-methoxy-phenoxy]acetate CAS Name: 2-[2-chloro-4-[[3-chloro-4-(1-pyrrolidinyl)anilino]methyl]-6-methoxyphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-chloro-4-[(3-chloro-4-pyrrolidin-1-ylanilino)methyl]-6-methoxyphenoxy]acetate Traditional Name: 2-[2-chloro-4-[(3-chloro-4-pyrrolidino-anilino)methyl]-6-methoxy-phenoxy]acetic acid methyl ester Formula: C21H24Cl2N2O4 MolecularWeight: 439.33226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=CC(=C(C=C2)N3CCCC3)Cl)Cl)OCC(=O)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=CC(=C(C=C2)N3CCCC3)Cl)Cl)OCC(=O)OC

InChI

InChI=1S/C21H24Cl2N2O4/c1-27-19-10-14(9-17(23)21(19)29-13-20(26)28-2)12-24-15-5-6-18(16(22)11-15)25-7-3-4-8-25/h5-6,9-11,24H,3-4,7-8,12-13H2,1-2H3