ethanoyl 2,2-bis[2-(2-chloroethylamino)phenyl]butanoate

Systemtic Name: ethanoyl 2,2-bis[2-(2-chloroethylamino)phenyl]butanoate Openeye Name: acetyl 2,2-bis[2-(2-chloroethylamino)phenyl]butanoate CAS Name: 2,2-bis[2-(2-chloroethylamino)phenyl]butanoic acid acetyl ester IUPAC Name: acetyl 2,2-bis[2-(2-chloroethylamino)phenyl]butanoate Traditional Name: 2,2-bis[2-(2-chloroethylamino)phenyl]butyric acid acetyl ester Formula: C22H26Cl2N2O3 MolecularWeight: 437.35944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1NCCCl)(C2=CC=CC=C2NCCCl)C(=O)OC(=O)C

Isomeric SMILES

CCC(C1=CC=CC=C1NCCCl)(C2=CC=CC=C2NCCCl)C(=O)OC(=O)C

InChI

InChI=1S/C22H26Cl2N2O3/c1-3-22(21(28)29-16(2)27,17-8-4-6-10-19(17)25-14-12-23)18-9-5-7-11-20(18)26-15-13-24/h4-11,25-26H,3,12-15H2,1-2H3