tert-butyl N-[(1R,3S)-1-(hydroxymethyl)-3-(4-octylphenyl)cyclopentyl]carbamate

Systemtic Name: tert-butyl N-[(1R,3S)-1-(hydroxymethyl)-3-(4-octylphenyl)cyclopentyl]carbamate Openeye Name: tert-butyl N-[(1R,3S)-1-(hydroxymethyl)-3-(4-octylphenyl)cyclopentyl]carbamate CAS Name: N-[(1R,3S)-1-(hydroxymethyl)-3-(4-octylphenyl)cyclopentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1R,3S)-1-(hydroxymethyl)-3-(4-octylphenyl)cyclopentyl]carbamate Traditional Name: N-[(1R,3S)-1-methylol-3-(4-octylphenyl)cyclopentyl]carbamic acid tert-butyl ester Formula: C25H41NO3 MolecularWeight: 403.59794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2CCC(C2)(CO)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)[C@H]2CC[C@@](C2)(CO)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H41NO3/c1-5-6-7-8-9-10-11-20-12-14-21(15-13-20)22-16-17-25(18-22,19-27)26-23(28)29-24(2,3)4/h12-15,22,27H,5-11,16-19H2,1-4H3,(H,26,28)/t22-,25+/m0/s1