ethyl 1-[(2,2-diphenyl-1,3-benzodioxol-5-yl)carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(2,2-diphenyl-1,3-benzodioxol-5-yl)carbonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-(2,2-diphenyl-1,3-benzodioxole-5-carbonyl)piperidine-3-carboxylate CAS Name: 1-[(2,2-diphenyl-1,3-benzodioxol-5-yl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,2-diphenyl-1,3-benzodioxole-5-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(2,2-diphenylpiperonyloyl)nipecotic acid ethyl ester Formula: C28H27NO5 MolecularWeight: 457.51768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C=C2)OC(O3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C=C2)OC(O3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27NO5/c1-2-32-27(31)21-10-9-17-29(19-21)26(30)20-15-16-24-25(18-20)34-28(33-24,22-11-5-3-6-12-22)23-13-7-4-8-14-23/h3-8,11-16,18,21H,2,9-10,17,19H2,1H3