(1-methylpyrrolidin-2-yl)methyl 2,2-bis(4-chloranylphenoxy)ethanoate hydrochloride

Systemtic Name: (1-methylpyrrolidin-2-yl)methyl 2,2-bis(4-chloranylphenoxy)ethanoate hydrochloride Openeye Name: (1-methylpyrrolidin-2-yl)methyl 2,2-bis(4-chlorophenoxy)acetate hydrochloride CAS Name: 2,2-bis(4-chlorophenoxy)acetic acid (1-methyl-2-pyrrolidinyl)methyl ester hydrochloride IUPAC Name: (1-methylpyrrolidin-2-yl)methyl 2,2-bis(4-chlorophenoxy)acetate hydrochloride Traditional Name: 2,2-bis(4-chlorophenoxy)acetic acid (1-methylpyrrolidin-2-yl)methyl ester hydrochloride Formula: C20H22Cl3NO4 MolecularWeight: 446.75198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1COC(=O)C(OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl.Cl

Isomeric SMILES

CN1CCCC1COC(=O)C(OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl.Cl

InChI

InChI=1S/C20H21Cl2NO4.ClH/c1-23-12-2-3-16(23)13-25-19(24)20(26-17-8-4-14(21)5-9-17)27-18-10-6-15(22)7-11-18;/h4-11,16,20H,2-3,12-13H2,1H3;1H