tert-butyl N-[[2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl]methyl]carbamate Openeye Name: tert-butyl N-[[6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-oxo-tetralin-5-yl]methyl]carbamate CAS Name: N-[[2-[2-(1-imidazolyl)-1-phenylethoxy]-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[2-(2-imidazol-1-yl-1-phenylethoxy)-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]methyl]carbamate Traditional Name: N-[[6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-keto-tetralin-5-yl]methyl]carbamic acid tert-butyl ester Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=C(C=CC2=C1CCCC2=O)OC(CN3C=CN=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=C(C=CC2=C1CCCC2=O)OC(CN3C=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4/c1-27(2,3)34-26(32)29-16-22-20-10-7-11-23(31)21(20)12-13-24(22)33-25(17-30-15-14-28-18-30)19-8-5-4-6-9-19/h4-6,8-9,12-15,18,25H,7,10-11,16-17H2,1-3H3,(H,29,32)