tert-butyl N-[(3S,6S)-2-oxidanylidene-6-phenylmethoxy-azepan-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3S,6S)-2-oxidanylidene-6-phenylmethoxy-azepan-3-yl]carbamate Openeye Name: tert-butyl N-[(3S,6S)-6-benzyloxy-2-oxo-azepan-3-yl]carbamate CAS Name: N-[(3S,6S)-2-oxo-6-phenylmethoxy-3-azepanyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S,6S)-2-oxo-6-phenylmethoxyazepan-3-yl]carbamate Traditional Name: N-[(3S,6S)-6-benzoxy-2-keto-azepan-3-yl]carbamic acid tert-butyl ester Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CNC1=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H]1CC[C@@H](CNC1=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H26N2O4/c1-18(2,3)24-17(22)20-15-10-9-14(11-19-16(15)21)23-12-13-7-5-4-6-8-13/h4-8,14-15H,9-12H2,1-3H3,(H,19,21)(H,20,22)/t14-,15-/m0/s1