(phenylmethyl) 2-[methyl-[3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propyl]carbamoyl]oxy-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[methyl-[3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propyl]carbamoyl]oxy-3-phenyl-propanoate Openeye Name: benzyl 2-[methyl-[3-(4-methylpiperazin-1-yl)-3-oxo-propyl]carbamoyl]oxy-3-phenyl-propanoate CAS Name: 2-[[methyl-[3-(4-methyl-1-piperazinyl)-3-oxopropyl]amino]-oxomethoxy]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[methyl-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]carbamoyl]oxy-3-phenylpropanoate Traditional Name: 2-[[3-keto-3-(4-methylpiperazino)propyl]-methyl-carbamoyl]oxy-3-phenyl-propionic acid benzyl ester Formula: C26H33N3O5 MolecularWeight: 467.55732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCN(C)C(=O)OC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C(=O)CCN(C)C(=O)OC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H33N3O5/c1-27-15-17-29(18-16-27)24(30)13-14-28(2)26(32)34-23(19-21-9-5-3-6-10-21)25(31)33-20-22-11-7-4-8-12-22/h3-12,23H,13-20H2,1-2H3