1-acetyloxyethyl 4-[4-[2-[4-(2-butoxy-2-oxidanylidene-ethoxy)phenyl]-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-1-yl]piperidine-1-carboxylate

Systemtic Name: 1-acetyloxyethyl 4-[4-[2-[4-(2-butoxy-2-oxidanylidene-ethoxy)phenyl]-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-1-yl]piperidine-1-carboxylate Openeye Name: 1-acetoxyethyl 4-[4-[2-[4-(2-butoxy-2-oxo-ethoxy)phenyl]-2-oxo-ethyl]-3-oxo-piperazin-1-yl]piperidine-1-carboxylate CAS Name: 4-[4-[2-[4-(2-butoxy-2-oxoethoxy)phenyl]-2-oxoethyl]-3-oxo-1-piperazinyl]-1-piperidinecarboxylic acid 1-acetyloxyethyl ester IUPAC Name: 1-acetyloxyethyl 4-[4-[2-[4-(2-butoxy-2-oxoethoxy)phenyl]-2-oxoethyl]-3-oxopiperazin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[2-[4-(2-butoxy-2-keto-ethoxy)phenyl]-2-keto-ethyl]-3-keto-piperazino]piperidine-1-carboxylic acid 1-acetoxyethyl ester Formula: C28H39N3O9 MolecularWeight: 561.62396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC1=CC=C(C=C1)C(=O)CN2CCN(CC2=O)C3CCN(CC3)C(=O)OC(C)OC(=O)C

Isomeric SMILES

CCCCOC(=O)COC1=CC=C(C=C1)C(=O)CN2CCN(CC2=O)C3CCN(CC3)C(=O)OC(C)OC(=O)C

InChI

InChI=1S/C28H39N3O9/c1-4-5-16-37-27(35)19-38-24-8-6-22(7-9-24)25(33)17-31-15-14-30(18-26(31)34)23-10-12-29(13-11-23)28(36)40-21(3)39-20(2)32/h6-9,21,23H,4-5,10-19H2,1-3H3