(2-aminocarbonyl-3-butyl-3-methyl-oxiran-2-yl)carbonyl 4-phenylpiperazine-1-carboxylate

Systemtic Name: (2-aminocarbonyl-3-butyl-3-methyl-oxiran-2-yl)carbonyl 4-phenylpiperazine-1-carboxylate Openeye Name: (3-butyl-2-carbamoyl-3-methyl-oxirane-2-carbonyl) 4-phenylpiperazine-1-carboxylate CAS Name: 4-phenyl-1-piperazinecarboxylic acid [(3-butyl-2-carbamoyl-3-methyl-2-oxiranyl)-oxomethyl] ester IUPAC Name: (3-butyl-2-carbamoyl-3-methyloxirane-2-carbonyl) 4-phenylpiperazine-1-carboxylate Traditional Name: 4-phenylpiperazine-1-carboxylic acid (3-butyl-2-carbamoyl-3-methyl-oxirane-2-carbonyl) ester Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(O1)(C(=O)N)C(=O)OC(=O)N2CCN(CC2)C3=CC=CC=C3)C

Isomeric SMILES

CCCCC1(C(O1)(C(=O)N)C(=O)OC(=O)N2CCN(CC2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H27N3O5/c1-3-4-10-19(2)20(28-19,16(21)24)17(25)27-18(26)23-13-11-22(12-14-23)15-8-6-5-7-9-15/h5-9H,3-4,10-14H2,1-2H3,(H2,21,24)