methyl 2-(2-chlorophenyl)-2-[4-(3,4-diethoxyphenyl)carbonylpiperazin-1-yl]ethanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-2-[4-(3,4-diethoxyphenyl)carbonylpiperazin-1-yl]ethanoate Openeye Name: methyl 2-(2-chlorophenyl)-2-[4-(3,4-diethoxybenzoyl)piperazin-1-yl]acetate CAS Name: 2-(2-chlorophenyl)-2-[4-[(3,4-diethoxyphenyl)-oxomethyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-2-[4-(3,4-diethoxybenzoyl)piperazin-1-yl]acetate Traditional Name: 2-(2-chlorophenyl)-2-[4-(3,4-diethoxybenzoyl)piperazino]acetic acid methyl ester Formula: C24H29ClN2O5 MolecularWeight: 460.95046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3Cl)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3Cl)C(=O)OC)OCC

InChI

InChI=1S/C24H29ClN2O5/c1-4-31-20-11-10-17(16-21(20)32-5-2)23(28)27-14-12-26(13-15-27)22(24(29)30-3)18-8-6-7-9-19(18)25/h6-11,16,22H,4-5,12-15H2,1-3H3