tert-butyl 2-[6-(3-oxidanylpropoxy)naphthalen-1-yl]pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-[6-(3-oxidanylpropoxy)naphthalen-1-yl]pyrrole-1-carboxylate Openeye Name: tert-butyl 2-[6-(3-hydroxypropoxy)-1-naphthyl]pyrrole-1-carboxylate CAS Name: 2-[6-(3-hydroxypropoxy)-1-naphthalenyl]-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[6-(3-hydroxypropoxy)naphthalen-1-yl]pyrrole-1-carboxylate Traditional Name: 2-[6-(3-hydroxypropoxy)-1-naphthyl]pyrrole-1-carboxylic acid tert-butyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC=C1C2=CC=CC3=C2C=CC(=C3)OCCCO

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC=C1C2=CC=CC3=C2C=CC(=C3)OCCCO

InChI

InChI=1S/C22H25NO4/c1-22(2,3)27-21(25)23-12-5-9-20(23)19-8-4-7-16-15-17(10-11-18(16)19)26-14-6-13-24/h4-5,7-12,15,24H,6,13-14H2,1-3H3