tert-butyl N-[(3aS,4R,6S,6aS)-6-oxidanyl-3-(phenylmethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,2,3]triazol-4-yl]carbamate

Systemtic Name: tert-butyl N-[(3aS,4R,6S,6aS)-6-oxidanyl-3-(phenylmethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,2,3]triazol-4-yl]carbamate Openeye Name: tert-butyl N-[(3aS,4R,6S,6aS)-3-benzyl-6-hydroxy-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]triazol-4-yl]carbamate CAS Name: N-[(3aS,4R,6S,6aS)-6-hydroxy-3-(phenylmethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]triazol-4-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3aS,4R,6S,6aS)-3-benzyl-6-hydroxy-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]triazol-4-yl]carbamate Traditional Name: N-[(3aS,4R,6S,6aS)-3-benzyl-6-hydroxy-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]triazol-4-yl]carbamic acid tert-butyl ester Formula: C17H24N4O3 MolecularWeight: 332.39746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC(C2C1N(N=N2)CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1C[C@@H]([C@@H]2[C@H]1N(N=N2)CC3=CC=CC=C3)O

InChI

InChI=1S/C17H24N4O3/c1-17(2,3)24-16(23)18-12-9-13(22)14-15(12)21(20-19-14)10-11-7-5-4-6-8-11/h4-8,12-15,22H,9-10H2,1-3H3,(H,18,23)/t12-,13+,14-,15+/m1/s1