2-(5,5-dimethyl-1,3-dioxan-2-yl)ethyl 4-[(4-chlorophenyl)-phenyl-methyl]piperazine-1-carboxylate

Systemtic Name: 2-(5,5-dimethyl-1,3-dioxan-2-yl)ethyl 4-[(4-chlorophenyl)-phenyl-methyl]piperazine-1-carboxylate Openeye Name: 2-(5,5-dimethyl-1,3-dioxan-2-yl)ethyl 4-[(4-chlorophenyl)-phenyl-methyl]piperazine-1-carboxylate CAS Name: 4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinecarboxylic acid 2-(5,5-dimethyl-1,3-dioxan-2-yl)ethyl ester IUPAC Name: 2-(5,5-dimethyl-1,3-dioxan-2-yl)ethyl 4-[(4-chlorophenyl)-phenylmethyl]piperazine-1-carboxylate Traditional Name: 4-[(4-chlorophenyl)-phenyl-methyl]piperazine-1-carboxylic acid 2-(5,5-dimethyl-1,3-dioxan-2-yl)ethyl ester Formula: C26H33ClN2O4 MolecularWeight: 473.00422

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)CCOC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1(COC(OC1)CCOC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C26H33ClN2O4/c1-26(2)18-32-23(33-19-26)12-17-31-25(30)29-15-13-28(14-16-29)24(20-6-4-3-5-7-20)21-8-10-22(27)11-9-21/h3-11,23-24H,12-19H2,1-2H3