(phenylmethyl) 2-butyl-5-(4-oxidanylideneheptyl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-butyl-5-(4-oxidanylideneheptyl)pyrrolidine-1-carboxylate Openeye Name: benzyl 2-butyl-5-(4-oxoheptyl)pyrrolidine-1-carboxylate CAS Name: 2-butyl-5-(4-oxoheptyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-butyl-5-(4-oxoheptyl)pyrrolidine-1-carboxylate Traditional Name: 2-butyl-5-(4-ketoheptyl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C23H35NO3 MolecularWeight: 373.5289

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(N1C(=O)OCC2=CC=CC=C2)CCCC(=O)CCC

Isomeric SMILES

CCCCC1CCC(N1C(=O)OCC2=CC=CC=C2)CCCC(=O)CCC

InChI

InChI=1S/C23H35NO3/c1-3-5-13-20-16-17-21(14-9-15-22(25)10-4-2)24(20)23(26)27-18-19-11-7-6-8-12-19/h6-8,11-12,20-21H,3-5,9-10,13-18H2,1-2H3