ethyl 4-[1,3-benzodioxol-5-ylmethyl-(2-methoxy-2-phenyl-ethanoyl)amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[1,3-benzodioxol-5-ylmethyl-(2-methoxy-2-phenyl-ethanoyl)amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[1,3-benzodioxol-5-ylmethyl-(2-methoxy-2-phenyl-acetyl)amino]piperidine-1-carboxylate CAS Name: 4-[1,3-benzodioxol-5-ylmethyl-(2-methoxy-1-oxo-2-phenylethyl)amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1,3-benzodioxol-5-ylmethyl-(2-methoxy-2-phenylacetyl)amino]piperidine-1-carboxylate Traditional Name: 4-[(2-methoxy-2-phenyl-acetyl)-piperonyl-amino]piperidine-1-carboxylic acid ethyl ester Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C(C4=CC=CC=C4)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C(C4=CC=CC=C4)OC

InChI

InChI=1S/C25H30N2O6/c1-3-31-25(29)26-13-11-20(12-14-26)27(16-18-9-10-21-22(15-18)33-17-32-21)24(28)23(30-2)19-7-5-4-6-8-19/h4-10,15,20,23H,3,11-14,16-17H2,1-2H3